N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide

C15H21N5O — CID 105067928

IUPACN-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)Nc1ccnn1C(C)C
InChIInChI=1S/C15H21N5O/c1-4-7-17-13-10-16-8-5-12(13)15(21)19-14-6-9-18-20(14)11(2)3/h5-6,8-11,17H,4,7H2,1-3H3,(H,19,21)
InChIKeyWSRWXBDQMKUGKP-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.93
Rot. Bonds6

About N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide

N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105067928) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
PubChem CID105067928
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)Nc1ccnn1C(C)C
InChIInChI=1S/C15H21N5O/c1-4-7-17-13-10-16-8-5-12(13)15(21)19-14-6-9-18-20(14)11(2)3/h5-6,8-11,17H,4,7H2,1-3H3,(H,19,21)
InChIKeyWSRWXBDQMKUGKP-UHFFFAOYSA-N
XLogP2.93
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(5-methyl-1,3,4-oxadiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105071358
N-(2-methylpentan-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105069100
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105070085
N-[1-(dimethylamino)propan-2-yl]-3-(propylamino)pyridine-4-carboxamide
CID 105070967
N-(4-methylhexan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105070483
3-(propylamino)-N-(2-pyrazol-1-ylethyl)pyridine-4-carboxamide
CID 105069612
N-(2,5-dibromophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105069309
N-(2-methoxyphenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105067884
N-(1-imidazol-1-ylpropan-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105069520
N-(4-methyl-1,3-thiazol-2-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105068083
N-(3-bromo-4-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071177

Frequently Asked Questions

What is the IUPAC name of N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide (CID 105067928) is N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)Nc1ccnn1C(C)C.
What is the InChIKey of N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is WSRWXBDQMKUGKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-7-17-13-10-16-8-5-12(13)15(21)19-14-6-9-18-20(14)11(2)3/h5-6,8-11,17H,4,7H2,1-3H3,(H,19,21).
What are the key properties of N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide?
N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 2.93, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105067928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).