N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide

C14H19N5O — CID 105070085

IUPACN-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCc1ccnn1C
InChIInChI=1S/C14H19N5O/c1-3-6-16-13-10-15-7-5-12(13)14(20)17-9-11-4-8-18-19(11)2/h4-5,7-8,10,16H,3,6,9H2,1-2H3,(H,17,20)
InChIKeyPKXZNAIBZMILCY-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.57
Rot. Bonds6

About N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide

N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105070085) has the molecular formula C14H19N5O and a molecular weight of 273.34 g/mol. Its IUPAC name is N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide
PubChem CID105070085
Molecular FormulaC14H19N5O
Molecular Weight273.34 g/mol
Exact Mass273.16
IUPAC NameN-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCc1ccnn1C
InChIInChI=1S/C14H19N5O/c1-3-6-16-13-10-15-7-5-12(13)14(20)17-9-11-4-8-18-19(11)2/h4-5,7-8,10,16H,3,6,9H2,1-2H3,(H,17,20)
InChIKeyPKXZNAIBZMILCY-UHFFFAOYSA-N
XLogP1.57
TPSA71.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(3-methyl-4-pyridinyl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071463
N-[(2-methyl-1,3-thiazol-5-yl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105069218
3-(propylamino)-N-(2-pyrazol-1-ylethyl)pyridine-4-carboxamide
CID 105069612
3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 105386261
N-(2-propan-2-ylpyrazol-3-yl)-3-(propylamino)pyridine-4-carboxamide
CID 105067928
N-[2-oxo-2-(propan-2-ylamino)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068732
N-(2-methoxy-2-methylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071169
N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide
CID 105068347
N-(3-methylsulfanylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105070236
N-[(2-methylpyrazol-3-yl)methyl]-4-(propylamino)pyridine-2-carboxamide
CID 63303394
N-(cyclopentylmethyl)-3-(propylamino)pyridine-4-carboxamide
CID 105068587
N-(3-butoxypropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071243

Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide (CID 105070085) is N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NCc1ccnn1C.
What is the InChIKey of N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is PKXZNAIBZMILCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O/c1-3-6-16-13-10-15-7-5-12(13)14(20)17-9-11-4-8-18-19(11)2/h4-5,7-8,10,16H,3,6,9H2,1-2H3,(H,17,20).
What are the key properties of N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide?
N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 273.34 g/mol, XLogP of 1.57, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpyrazol-3-yl)methyl]-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105070085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).