N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide

C112H115N25O11 — CID 159070844

IUPACN-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1cnc2ccc(-c3ccc4oc(C)nc4c3)cn12.Cc1ccc(NC(=O)c2cnc3ccc(-c4ccc5oc(C)nc5c4)cn23)cn1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCCN5CCCC5)n4c3)ccc2o1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCCN5CCOCC5)n4c3)ccc2o1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCN5CCCC5)n4c3)ccc2o1
InChIInChI=1S/C23H25N5O3.C23H25N5O2.C22H17N5O2.C22H23N5O2.C22H25N5O2/c1-16-26-19-13-17(3-5-21(19)31-16)18-4-6-22-25-14-20(28(22)15-18)23(29)24-7-2-8-27-9-11-30-12-10-27;1-16-26-19-13-17(5-7-21(19)30-16)18-6-8-22-25-14-20(28(22)15-18)23(29)24-9-4-12-27-10-2-3-11-27;1-13-3-6-17(10-23-13)26-22(28)19-11-24-21-8-5-16(12-27(19)21)15-4-7-20-18(9-15)25-14(2)29-20;1-15-25-18-12-16(4-6-20(18)29-15)17-5-7-21-24-13-19(27(21)14-17)22(28)23-8-11-26-9-2-3-10-26;1-4-26(5-2)11-10-23-22(28)19-13-24-21-9-7-17(14-27(19)21)16-6-8-20-18(12-16)25-15(3)29-20/h3-6,13-15H,2,7-12H2,1H3,(H,24,29);5-8,13-15H,2-4,9-12H2,1H3,(H,24,29);3-12H,1-2H3,(H,26,28);4-7,12-14H,2-3,8-11H2,1H3,(H,23,28);6-9,12-14H,4-5,10-11H2,1-3H3,(H,23,28)
InChIKeyJZPYXYAWNBSAFP-UHFFFAOYSA-N
MW1987.32 g/mol
LogP17.78
Rot. Bonds27

About N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide

N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 159070844) has the molecular formula C112H115N25O11 and a molecular weight of 1987.32 g/mol. Its IUPAC name is N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID159070844
Molecular FormulaC112H115N25O11
Molecular Weight1987.32 g/mol
Exact Mass1985.92
IUPAC NameN-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCCN(CC)CCNC(=O)c1cnc2ccc(-c3ccc4oc(C)nc4c3)cn12.Cc1ccc(NC(=O)c2cnc3ccc(-c4ccc5oc(C)nc5c4)cn23)cn1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCCN5CCCC5)n4c3)ccc2o1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCCN5CCOCC5)n4c3)ccc2o1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCN5CCCC5)n4c3)ccc2o1
InChIInChI=1S/C23H25N5O3.C23H25N5O2.C22H17N5O2.C22H23N5O2.C22H25N5O2/c1-16-26-19-13-17(3-5-21(19)31-16)18-4-6-22-25-14-20(28(22)15-18)23(29)24-7-2-8-27-9-11-30-12-10-27;1-16-26-19-13-17(5-7-21(19)30-16)18-6-8-22-25-14-20(28(22)15-18)23(29)24-9-4-12-27-10-2-3-11-27;1-13-3-6-17(10-23-13)26-22(28)19-11-24-21-8-5-16(12-27(19)21)15-4-7-20-18(9-15)25-14(2)29-20;1-15-25-18-12-16(4-6-20(18)29-15)17-5-7-21-24-13-19(27(21)14-17)22(28)23-8-11-26-9-2-3-10-26;1-4-26(5-2)11-10-23-22(28)19-13-24-21-9-7-17(14-27(19)21)16-6-8-20-18(12-16)25-15(3)29-20/h3-6,13-15H,2,7-12H2,1H3,(H,24,29);5-8,13-15H,2-4,9-12H2,1H3,(H,24,29);3-12H,1-2H3,(H,26,28);4-7,12-14H,2-3,8-11H2,1H3,(H,23,28);6-9,12-14H,4-5,10-11H2,1-3H3,(H,23,28)
InChIKeyJZPYXYAWNBSAFP-UHFFFAOYSA-N
XLogP17.78
TPSA397.23 Ų
H-Bond Donors5
H-Bond Acceptors31
Rotatable Bonds27
Heavy Atoms148
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001987.32
LogP ≤ 517.78
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide with MolForge

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Related Compounds

Serabelisib
CID 70798655
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-piperazin-1-ylmethanone
CID 70798412
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[4-(dimethylamino)piperidin-1-yl]methanone
CID 70798544
(2S)-1-[6-(2-amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carbonyl]pyrrolidine-2-carboxamide
CID 70798705
6-(1,3-benzoxazol-5-yl)-N-[(4-methoxyphenyl)methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 164610761
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[3-(3,3-difluoropyrrolidin-1-yl)pyrrolidin-1-yl]methanone
CID 50991339
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(4,4-difluoropiperidin-1-yl)methanone
CID 50991340
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(4-fluoropiperidin-1-yl)methanone
CID 70798436
[6-(2-amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(3S)-3-fluoropyrrolidin-1-yl]methanone
CID 70798504
[6-(2-amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[(3R)-3-fluoropyrrolidin-1-yl]methanone
CID 70798516
[6-(2-Amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(3,3-difluoropyrrolidin-1-yl)methanone
CID 70798615
[6-(2-Amino-6-fluoro-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-morpholin-4-ylmethanone
CID 70798725

Frequently Asked Questions

What is the IUPAC name of N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide (CID 159070844) is N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide is CCN(CC)CCNC(=O)c1cnc2ccc(-c3ccc4oc(C)nc4c3)cn12.Cc1ccc(NC(=O)c2cnc3ccc(-c4ccc5oc(C)nc5c4)cn23)cn1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCCN5CCCC5)n4c3)ccc2o1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCCN5CCOCC5)n4c3)ccc2o1.Cc1nc2cc(-c3ccc4ncc(C(=O)NCCN5CCCC5)n4c3)ccc2o1.
What is the InChIKey of N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is JZPYXYAWNBSAFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N5O3.C23H25N5O2.C22H17N5O2.C22H23N5O2.C22H25N5O2/c1-16-26-19-13-17(3-5-21(19)31-16)18-4-6-22-25-14-20(28(22)15-18)23(29)24-7-2-8-27-9-11-30-12-10-27;1-16-26-19-13-17(5-7-21(19)30-16)18-6-8-22-25-14-20(28(22)15-18)23(29)24-9-4-12-27-10-2-3-11-27;1-13-3-6-17(10-23-13)26-22(28)19-11-24-21-8-5-16(12-27(19)21)15-4-7-20-18(9-15)25-14(2)29-20;1-15-25-18-12-16(4-6-20(18)29-15)17-5-7-21-24-13-19(27(21)14-17)22(28)23-8-11-26-9-2-3-10-26;1-4-26(5-2)11-10-23-22(28)19-13-24-21-9-7-17(14-27(19)21)16-6-8-20-18(12-16)25-15(3)29-20/h3-6,13-15H,2,7-12H2,1H3,(H,24,29);5-8,13-15H,2-4,9-12H2,1H3,(H,24,29);3-12H,1-2H3,(H,26,28);4-7,12-14H,2-3,8-11H2,1H3,(H,23,28);6-9,12-14H,4-5,10-11H2,1-3H3,(H,23,28).
What are the key properties of N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide?
N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 1987.32 g/mol, XLogP of 17.78, 27 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(diethylamino)ethyl]-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(6-methyl-3-pyridinyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-morpholin-4-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(3-pyrrolidin-1-ylpropyl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 159070844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).