N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide

C15H21N5O — CID 62903269

IUPACN-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2cnn(C(C)C)c2)cn1
InChIInChI=1S/C15H21N5O/c1-4-7-16-14-6-5-12(8-17-14)15(21)19-13-9-18-20(10-13)11(2)3/h5-6,8-11H,4,7H2,1-3H3,(H,16,17)(H,19,21)
InChIKeyRWVKQYYRDYJASD-UHFFFAOYSA-N
MW287.37 g/mol
LogP2.93
Rot. Bonds6

About N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide

N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide (PubChem CID 62903269) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide
PubChem CID62903269
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC NameN-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide
SMILESCCCNc1ccc(C(=O)Nc2cnn(C(C)C)c2)cn1
InChIInChI=1S/C15H21N5O/c1-4-7-16-14-6-5-12(8-17-14)15(21)19-13-9-18-20(10-13)11(2)3/h5-6,8-11H,4,7H2,1-3H3,(H,16,17)(H,19,21)
InChIKeyRWVKQYYRDYJASD-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

6-bromo-N-(1-propan-2-ylpyrazol-4-yl)pyridine-3-carboxamide
CID 66462563
N-(1-propan-2-ylpyrazol-4-yl)-2-(propylamino)benzamide
CID 62903618
N-(3,4-difluorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62166701
6-(propylamino)-N-pyrimidin-2-ylpyridine-3-carboxamide
CID 62172448
N-(4-tert-butylphenyl)-6-(pentylamino)pyridine-3-carboxamide
CID 109161313
N-[4-(4-methylpiperazin-1-yl)phenyl]-6-(propylamino)pyridine-3-carboxamide
CID 109151220
N-(2-methylbutyl)-6-(propylamino)pyridine-3-carboxamide
CID 62693585
N-[1-oxo-1-(propylamino)propan-2-yl]-6-(propylamino)pyridine-3-carboxamide
CID 62178002
N-(3,5-dimethylphenyl)-6-(pentylamino)pyridine-3-carboxamide
CID 109161304
N-(4-bromo-3-chlorophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 107616648
N-(2-iodophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 62166866
N-(2,6-dibromophenyl)-6-(propylamino)pyridine-3-carboxamide
CID 107603238

Frequently Asked Questions

What is the IUPAC name of N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide?
The IUPAC name of N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide (CID 62903269) is N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide is CCCNc1ccc(C(=O)Nc2cnn(C(C)C)c2)cn1.
What is the InChIKey of N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide?
The InChIKey is RWVKQYYRDYJASD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-4-7-16-14-6-5-12(8-17-14)15(21)19-13-9-18-20(10-13)11(2)3/h5-6,8-11H,4,7H2,1-3H3,(H,16,17)(H,19,21).
What are the key properties of N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide?
N-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-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-(1-propan-2-ylpyrazol-4-yl)-6-(propylamino)pyridine-3-carboxamide is sourced from PubChem (CID 62903269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).