2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide

C15H21N5O — CID 62039632

IUPAC2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide
SMILESCc1[nH]ncc1CCCNC(=O)c1ccnc(N(C)C)c1
InChIInChI=1S/C15H21N5O/c1-11-13(10-18-19-11)5-4-7-17-15(21)12-6-8-16-14(9-12)20(2)3/h6,8-10H,4-5,7H2,1-3H3,(H,17,21)(H,18,19)
InChIKeyYTDAAHHKKDFVFK-UHFFFAOYSA-N
MW287.37 g/mol
LogP1.54
Rot. Bonds6

About 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide

2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide (PubChem CID 62039632) has the molecular formula C15H21N5O and a molecular weight of 287.37 g/mol. Its IUPAC name is 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide
PubChem CID62039632
Molecular FormulaC15H21N5O
Molecular Weight287.37 g/mol
Exact Mass287.17
IUPAC Name2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide
SMILESCc1[nH]ncc1CCCNC(=O)c1ccnc(N(C)C)c1
InChIInChI=1S/C15H21N5O/c1-11-13(10-18-19-11)5-4-7-17-15(21)12-6-8-16-14(9-12)20(2)3/h6,8-10H,4-5,7H2,1-3H3,(H,17,21)(H,18,19)
InChIKeyYTDAAHHKKDFVFK-UHFFFAOYSA-N
XLogP1.54
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.37
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

6-methyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-3-carboxamide
CID 62039665
3-iodo-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]benzamide
CID 62038999
N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-2H-benzotriazole-5-carboxamide
CID 62039846
2-(dimethylamino)-N-[2-(dimethylamino)ethyl]pyridine-4-carboxamide
CID 84574435
3-(chloromethyl)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]benzamide
CID 62038357
6-methoxy-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-3-carboxamide
CID 62039228
N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-2H-triazole-4-carboxamide
CID 78924905
5-chloro-2-methyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]benzamide
CID 115532278
N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]-2-(1H-pyrazol-5-yl)acetamide
CID 79004761
2,4-dihydroxy-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]benzamide
CID 62039236
4-hydroxy-2-methyl-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]benzamide
CID 103872854
2,5-dibromo-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]benzamide
CID 114372171

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide (CID 62039632) is 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide is Cc1[nH]ncc1CCCNC(=O)c1ccnc(N(C)C)c1.
What is the InChIKey of 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide?
The InChIKey is YTDAAHHKKDFVFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5O/c1-11-13(10-18-19-11)5-4-7-17-15(21)12-6-8-16-14(9-12)20(2)3/h6,8-10H,4-5,7H2,1-3H3,(H,17,21)(H,18,19).
What are the key properties of 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide?
2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide has a molecular weight of 287.37 g/mol, XLogP of 1.54, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-[3-(5-methyl-1H-pyrazol-4-yl)propyl]pyridine-4-carboxamide is sourced from PubChem (CID 62039632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).