N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide

C14H24N4O — CID 105068347

IUPACN-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCCCN(C)C
InChIInChI=1S/C14H24N4O/c1-4-7-16-13-11-15-9-6-12(13)14(19)17-8-5-10-18(2)3/h6,9,11,16H,4-5,7-8,10H2,1-3H3,(H,17,19)
InChIKeyQKMQATQALLXRLE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.59
Rot. Bonds8

About N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide

N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide (PubChem CID 105068347) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide
PubChem CID105068347
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1cnccc1C(=O)NCCCN(C)C
InChIInChI=1S/C14H24N4O/c1-4-7-16-13-11-15-9-6-12(13)14(19)17-8-5-10-18(2)3/h6,9,11,16H,4-5,7-8,10H2,1-3H3,(H,17,19)
InChIKeyQKMQATQALLXRLE-UHFFFAOYSA-N
XLogP1.59
TPSA57.26 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.59
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

N-(3-methylsulfanylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105070236
N-(3-butoxypropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071243
N-[2-(dimethylsulfamoyl)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 106342677
N-(3-cyclopropylpropyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071385
N-(5-hydroxypentyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 107201068
N-(3-methoxypropyl)-N-methyl-3-(propylamino)pyridine-4-carboxamide
CID 105069961
N-[2-(1H-imidazol-2-yl)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071332
N-[1-(dimethylamino)propan-2-yl]-3-(propylamino)pyridine-4-carboxamide
CID 105070967
N-[2-[ethyl(methyl)amino]ethyl]-4-(propylamino)pyridine-3-carboxamide
CID 81240941
N-[3-(dimethylamino)propyl]-5-methyl-2-(propylamino)benzamide
CID 62510706
N-[(3-methyl-4-pyridinyl)methyl]-3-(propylamino)pyridine-4-carboxamide
CID 105071463
3-(propylamino)-N-(2-pyrazol-1-ylethyl)pyridine-4-carboxamide
CID 105069612

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide?
The IUPAC name of N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide (CID 105068347) is N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide is CCCNc1cnccc1C(=O)NCCCN(C)C.
What is the InChIKey of N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide?
The InChIKey is QKMQATQALLXRLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-4-7-16-13-11-15-9-6-12(13)14(19)17-8-5-10-18(2)3/h6,9,11,16H,4-5,7-8,10H2,1-3H3,(H,17,19).
What are the key properties of N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide?
N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide has a molecular weight of 264.37 g/mol, XLogP of 1.59, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)propyl]-3-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105068347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).