N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide

C15H18N4OS — CID 105069328

IUPACN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)Nc1nc(C2CC2)cs1
InChIInChI=1S/C15H18N4OS/c1-2-6-17-12-8-16-7-5-11(12)14(20)19-15-18-13(9-21-15)10-3-4-10/h5,7-10,17H,2-4,6H2,1H3,(H,18,19,20)
InChIKeyBKPIQGKYAIGCAC-UHFFFAOYSA-N
MW302.40 g/mol
LogP3.49
Rot. Bonds6

About N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide

N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105069328) has the molecular formula C15H18N4OS and a molecular weight of 302.40 g/mol. Its IUPAC name is N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID105069328
Molecular FormulaC15H18N4OS
Molecular Weight302.40 g/mol
Exact Mass302.12
IUPAC NameN-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)Nc1nc(C2CC2)cs1
InChIInChI=1S/C15H18N4OS/c1-2-6-17-12-8-16-7-5-11(12)14(20)19-15-18-13(9-21-15)10-3-4-10/h5,7-10,17H,2-4,6H2,1H3,(H,18,19,20)
InChIKeyBKPIQGKYAIGCAC-UHFFFAOYSA-N
XLogP3.49
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.40
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105068083
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-(propylamino)pyridine-3-carboxamide
CID 62174643
N-cyclooctyl-3-(propylamino)pyridine-4-carboxamide
CID 105067977
1-N,4-N-bis(4-cyclopropyl-1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
CID 32869371
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587
N-(3-cyclopropylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071385
N-(5-methyl-1,3,4-oxadiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105071358
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385572
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
5-bromo-N-(4-cyclopropyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 32865110
3-(propylamino)-N-(thiolan-2-ylmethyl)pyridine-4-carboxamide
CID 105070782
N-(4-cyclopropyl-1,3-thiazol-2-yl)-2-ethyl-1,3-thiazole-5-carboxamide
CID 47426290

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide (CID 105069328) is N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)Nc1nc(C2CC2)cs1.
What is the InChIKey of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is BKPIQGKYAIGCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4OS/c1-2-6-17-12-8-16-7-5-11(12)14(20)19-15-18-13(9-21-15)10-3-4-10/h5,7-10,17H,2-4,6H2,1H3,(H,18,19,20).
What are the key properties of N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide?
N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 302.40 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopropyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105069328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).