N,N-diethyl-4-(propylamino)pyridine-2-carboxamide

C13H21N3O — CID 43395263

IUPACN,N-diethyl-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)N(CC)CC)c1
InChIInChI=1S/C13H21N3O/c1-4-8-14-11-7-9-15-12(10-11)13(17)16(5-2)6-3/h7,9-10H,4-6,8H2,1-3H3,(H,14,15)
InChIKeyGMFDPLHKXNDNEK-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.39
Rot. Bonds6

About N,N-diethyl-4-(propylamino)pyridine-2-carboxamide

N,N-diethyl-4-(propylamino)pyridine-2-carboxamide (PubChem CID 43395263) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is N,N-diethyl-4-(propylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-(propylamino)pyridine-2-carboxamide
PubChem CID43395263
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC NameN,N-diethyl-4-(propylamino)pyridine-2-carboxamide
SMILESCCCNc1ccnc(C(=O)N(CC)CC)c1
InChIInChI=1S/C13H21N3O/c1-4-8-14-11-7-9-15-12(10-11)13(17)16(5-2)6-3/h7,9-10H,4-6,8H2,1-3H3,(H,14,15)
InChIKeyGMFDPLHKXNDNEK-UHFFFAOYSA-N
XLogP2.39
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-N-(2-hydroxy-2-methylpropyl)-4-(propylamino)pyridine-2-carboxamide
CID 79386430
N-(cyclopropylmethyl)-N-ethyl-4-(propylamino)pyridine-2-carboxamide
CID 63939735
N,N-diethyl-4-(2,2,2-trifluoroethylamino)pyridine-2-carboxamide
CID 43517418
N,N-diethyl-4-(pent-4-ynylamino)pyridine-2-carboxamide
CID 106222471
N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide
CID 62693747
4-[(3-amino-2,2-difluoropropyl)amino]-N,N-diethylpyridine-2-carboxamide
CID 114384362
N,N-diethyl-4-[(2-hydroxy-2-methylpentyl)amino]pyridine-2-carboxamide
CID 106290832
N-(2-cyanoethyl)-N-(2-methylpropyl)-4-(propylamino)pyridine-2-carboxamide
CID 62181706
4-(2,3-dihydroxypropylamino)-N,N-diethylpyridine-2-carboxamide
CID 66175860
4-[2-(3-chlorophenyl)ethylamino]-N,N-diethylpyridine-2-carboxamide
CID 109216384
2-[[[2-(diethylcarbamoyl)-4-pyridinyl]amino]methyl]butanoic acid
CID 65226330
N,N-diethyl-4-[[2-methyl-3-(methylamino)propyl]amino]pyridine-2-carboxamide
CID 115303183

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-(propylamino)pyridine-2-carboxamide?
The IUPAC name of N,N-diethyl-4-(propylamino)pyridine-2-carboxamide (CID 43395263) is N,N-diethyl-4-(propylamino)pyridine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-4-(propylamino)pyridine-2-carboxamide?
The canonical SMILES for N,N-diethyl-4-(propylamino)pyridine-2-carboxamide is CCCNc1ccnc(C(=O)N(CC)CC)c1.
What is the InChIKey of N,N-diethyl-4-(propylamino)pyridine-2-carboxamide?
The InChIKey is GMFDPLHKXNDNEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-4-8-14-11-7-9-15-12(10-11)13(17)16(5-2)6-3/h7,9-10H,4-6,8H2,1-3H3,(H,14,15).
What are the key properties of N,N-diethyl-4-(propylamino)pyridine-2-carboxamide?
N,N-diethyl-4-(propylamino)pyridine-2-carboxamide has a molecular weight of 235.33 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-(propylamino)pyridine-2-carboxamide is sourced from PubChem (CID 43395263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).