3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide

C19H19N5OS — CID 141440778

IUPAC3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide
SMILESCc1nc(N)sc1-c1ccnc(Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C19H19N5OS/c1-11-17(26-19(20)22-11)12-7-8-21-16(10-12)23-15-4-2-3-13(9-15)18(25)24-14-5-6-14/h2-4,7-10,14H,5-6H2,1H3,(H2,20,22)(H,21,23)(H,24,25)
InChIKeyXSUAZRLNWBYQOI-UHFFFAOYSA-N
MW365.46 g/mol
LogP3.73
Rot. Bonds5

About 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide

3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide (PubChem CID 141440778) has the molecular formula C19H19N5OS and a molecular weight of 365.46 g/mol. Its IUPAC name is 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide.

Molecular Properties

Compound Name3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide
PubChem CID141440778
Molecular FormulaC19H19N5OS
Molecular Weight365.46 g/mol
Exact Mass365.13
IUPAC Name3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide
SMILESCc1nc(N)sc1-c1ccnc(Nc2cccc(C(=O)NC3CC3)c2)c1
InChIInChI=1S/C19H19N5OS/c1-11-17(26-19(20)22-11)12-7-8-21-16(10-12)23-15-4-2-3-13(9-15)18(25)24-14-5-6-14/h2-4,7-10,14H,5-6H2,1H3,(H2,20,22)(H,21,23)(H,24,25)
InChIKeyXSUAZRLNWBYQOI-UHFFFAOYSA-N
XLogP3.73
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.46
LogP ≤ 53.73
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

3-[[4-[(2,6-dimethyl-3-pyridinyl)oxy]-2-pyridinyl]amino]-N-(1-methylpiperidin-4-yl)benzamide
CID 68939373
2-(3-bromoanilino)-N-cyclohexylpyridine-4-carboxamide
CID 109166315
N-[4-methyl-5-[2-[3-(trifluoromethyl)anilino]-4-pyridinyl]-1,3-thiazol-2-yl]cyclopropanecarboxamide
CID 141440807
N-cyclopentyl-3-[2-(methylamino)-4-pyridinyl]benzamide
CID 123855665
N-cyclopentyl-3-[[6-(3-methylphenyl)pyridazin-3-yl]amino]benzamide
CID 50778643
N-cyclopropyl-3-(cyclopropylamino)benzamide
CID 103438850
3-(carbamoylamino)-N-cyclopropylbenzamide
CID 9210111
2-(3-acetylanilino)-N-cyclopropylpyrimidine-5-carboxamide
CID 109247399
2-N-(3-acetylphenyl)-4-N-cyclopentylpyridine-2,4-dicarboxamide
CID 109080814
N-[3-(cyclopropylcarbamoyl)phenyl]-2-(4-ethylphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 24506420
N-cyclopropyl-2-[4-(4-methylpiperazin-1-yl)anilino]pyridine-4-carboxamide
CID 109165227
N-[3-(cyclopropylcarbamoyl)phenyl]-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 17494544

Frequently Asked Questions

What is the IUPAC name of 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide?
The IUPAC name of 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide (CID 141440778) is 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide.
What is the SMILES notation for 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide?
The canonical SMILES for 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide is Cc1nc(N)sc1-c1ccnc(Nc2cccc(C(=O)NC3CC3)c2)c1.
What is the InChIKey of 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide?
The InChIKey is XSUAZRLNWBYQOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5OS/c1-11-17(26-19(20)22-11)12-7-8-21-16(10-12)23-15-4-2-3-13(9-15)18(25)24-14-5-6-14/h2-4,7-10,14H,5-6H2,1H3,(H2,20,22)(H,21,23)(H,24,25).
What are the key properties of 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide?
3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide has a molecular weight of 365.46 g/mol, XLogP of 3.73, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[4-(2-amino-4-methyl-1,3-thiazol-5-yl)-2-pyridinyl]amino]-N-cyclopropylbenzamide is sourced from PubChem (CID 141440778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).