6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

C22H23N5O2 — CID 118241085

IUPAC6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2cc(-c3ccc4ncc(C(=O)NC5CCN(C)CC5)n4c3)ccc2o1
InChIInChI=1S/C22H23N5O2/c1-14-24-18-11-15(3-5-20(18)29-14)16-4-6-21-23-12-19(27(21)13-16)22(28)25-17-7-9-26(2)10-8-17/h3-6,11-13,17H,7-10H2,1-2H3,(H,25,28)
InChIKeyPQNUUTJRUFNPDR-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.27
Rot. Bonds3

About 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide

6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 118241085) has the molecular formula C22H23N5O2 and a molecular weight of 389.46 g/mol. Its IUPAC name is 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID118241085
Molecular FormulaC22H23N5O2
Molecular Weight389.46 g/mol
Exact Mass389.19
IUPAC Name6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2cc(-c3ccc4ncc(C(=O)NC5CCN(C)CC5)n4c3)ccc2o1
InChIInChI=1S/C22H23N5O2/c1-14-24-18-11-15(3-5-20(18)29-14)16-4-6-21-23-12-19(27(21)13-16)22(28)25-17-7-9-26(2)10-8-17/h3-6,11-13,17H,7-10H2,1-2H3,(H,25,28)
InChIKeyPQNUUTJRUFNPDR-UHFFFAOYSA-N
XLogP3.27
TPSA75.67 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2-methyl-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 118241111
[4-(cyclopropylmethyl)piperazin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;N-(4-hydroxycyclohexyl)-6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carboxamide;[4-(2-hydroxyethyl)piperazin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;N-[1-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carbonyl]piperidin-4-yl]acetamide;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(4-propan-2-ylpiperazin-1-yl)methanone;6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 162139711
[(3S)-3-hydroxypyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone
CID 118241077
(2S)-1-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridine-3-carbonyl]pyrrolidine-2-carboxamide
CID 118241088
6-(2-amino-1,3-benzoxazol-5-yl)-N-[2-(4-methylpiperazin-1-yl)ethyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 70798553
(4-aminopiperidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;(3-hydroxyazetidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;(3-hydroxypyrrolidin-1-yl)-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(2-methylmorpholin-4-yl)methanone;[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[4-(2-methylsulfonylethyl)piperazin-1-yl]methanone;6-(2-methyl-1,3-benzoxazol-5-yl)-N-[1-(2-methylsulfonylethyl)piperidin-4-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 162216854
[3-(3,3-difluoropyrrolidin-1-yl)pyrrolidin-1-yl]-[6-(2-methyl-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]methanone
CID 118241131
6-(2-amino-1,3-benzoxazol-5-yl)-N-(2-pyrrolidin-1-ylethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 70798569
[6-(2-amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-[3-(4-methylpiperazin-1-yl)azetidin-1-yl]methanone
CID 70798654
ethane;6-methyl-N-(oxan-4-yl)imidazo[1,2-a]pyridine-3-carboxamide
CID 145449183
[6-(2-amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(1,4-oxazepan-4-yl)methanone
CID 145052109
[6-(2-amino-1,3-benzoxazol-5-yl)imidazo[1,2-a]pyridin-3-yl]-(2,2,3,3,5,5,6,6-octadeuteriomorpholin-4-yl)methanone
CID 89212502

Frequently Asked Questions

What is the IUPAC name of 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide (CID 118241085) is 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2cc(-c3ccc4ncc(C(=O)NC5CCN(C)CC5)n4c3)ccc2o1.
What is the InChIKey of 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is PQNUUTJRUFNPDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5O2/c1-14-24-18-11-15(3-5-20(18)29-14)16-4-6-21-23-12-19(27(21)13-16)22(28)25-17-7-9-26(2)10-8-17/h3-6,11-13,17H,7-10H2,1-2H3,(H,25,28).
What are the key properties of 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide?
6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 389.46 g/mol, XLogP of 3.27, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methyl-1,3-benzoxazol-5-yl)-N-(1-methylpiperidin-4-yl)imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 118241085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).