2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide

C14H13N5OS — CID 71685846

IUPAC2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide
SMILESCC(C(=O)Nc1nc(-c2cccnc2)cs1)n1ccnc1
InChIInChI=1S/C14H13N5OS/c1-10(19-6-5-16-9-19)13(20)18-14-17-12(8-21-14)11-3-2-4-15-7-11/h2-10H,1H3,(H,17,18,20)
InChIKeyGTTLCVCVNSHXSA-UHFFFAOYSA-N
MW299.36 g/mol
LogP2.60
Rot. Bonds4

About 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide

2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide (PubChem CID 71685846) has the molecular formula C14H13N5OS and a molecular weight of 299.36 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide.

Molecular Properties

Compound Name2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide
PubChem CID71685846
Molecular FormulaC14H13N5OS
Molecular Weight299.36 g/mol
Exact Mass299.08
IUPAC Name2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide
SMILESCC(C(=O)Nc1nc(-c2cccnc2)cs1)n1ccnc1
InChIInChI=1S/C14H13N5OS/c1-10(19-6-5-16-9-19)13(20)18-14-17-12(8-21-14)11-3-2-4-15-7-11/h2-10H,1H3,(H,17,18,20)
InChIKeyGTTLCVCVNSHXSA-UHFFFAOYSA-N
XLogP2.60
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.36
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2S)-2-imidazol-1-yl-N-[4-[(2S)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-1,3-thiazol-2-yl]propanamide
CID 51593481
(2S)-2-imidazol-1-yl-N-[4-[(2R)-2-methyl-2,3-dihydro-1-benzofuran-5-yl]-1,3-thiazol-2-yl]propanamide
CID 51593480
(2S)-N-[4-(2,5-dimethoxyphenyl)-1,3-thiazol-2-yl]-2-imidazol-1-ylpropanamide
CID 51583896
1,1-bis(2-methylpropyl)-3-(4-pyridin-3-yl-1,3-thiazol-2-yl)urea
CID 87009120
4-acetamido-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)benzamide
CID 2463732
(2R)-N-(4-phenyl-1,3-thiazol-2-yl)-2-[(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)sulfanyl]propanamide
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2-tert-butylsulfanyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)acetamide
CID 35874851
(1S,5R)-6,6-dimethyl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-3-azabicyclo[3.1.0]hexane-3-carboxamide
CID 97090370
2-methyl-N-(4-pyridin-4-yl-1,3-thiazol-2-yl)propanamide
CID 4800922
4-amino-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)butanamide
CID 110460819
3-phenoxy-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide
CID 110441097
N-(4-pyridin-3-yl-1,3-thiazol-2-yl)-4-pyrrol-1-ylbenzamide
CID 17450848

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide?
The IUPAC name of 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide (CID 71685846) is 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide.
What is the SMILES notation for 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide?
The canonical SMILES for 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide is CC(C(=O)Nc1nc(-c2cccnc2)cs1)n1ccnc1.
What is the InChIKey of 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide?
The InChIKey is GTTLCVCVNSHXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N5OS/c1-10(19-6-5-16-9-19)13(20)18-14-17-12(8-21-14)11-3-2-4-15-7-11/h2-10H,1H3,(H,17,18,20).
What are the key properties of 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide?
2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide has a molecular weight of 299.36 g/mol, XLogP of 2.60, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-(4-pyridin-3-yl-1,3-thiazol-2-yl)propanamide is sourced from PubChem (CID 71685846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).