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

C15H25N3O — CID 62693747

IUPACN,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide
SMILESCCC(C)CNc1ccnc(C(=O)N(CC)CC)c1
InChIInChI=1S/C15H25N3O/c1-5-12(4)11-17-13-8-9-16-14(10-13)15(19)18(6-2)7-3/h8-10,12H,5-7,11H2,1-4H3,(H,16,17)
InChIKeyYWPVBSLTEUSKBG-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.02
Rot. Bonds7

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

N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide (PubChem CID 62693747) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide
PubChem CID62693747
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide
SMILESCCC(C)CNc1ccnc(C(=O)N(CC)CC)c1
InChIInChI=1S/C15H25N3O/c1-5-12(4)11-17-13-8-9-16-14(10-13)15(19)18(6-2)7-3/h8-10,12H,5-7,11H2,1-4H3,(H,16,17)
InChIKeyYWPVBSLTEUSKBG-UHFFFAOYSA-N
XLogP3.02
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-diethyl-4-[[2-methyl-3-(methylamino)propyl]amino]pyridine-2-carboxamide
CID 115303183
2-[[[2-(diethylcarbamoyl)-4-pyridinyl]amino]methyl]butanoic acid
CID 65226330
4-(2,3-dihydroxypropylamino)-N,N-diethylpyridine-2-carboxamide
CID 66175860
N,N-diethyl-4-(propylamino)pyridine-2-carboxamide
CID 43395263
2-[[2-(diethylcarbamoyl)-4-pyridinyl]amino]propanoic acid
CID 43517392
N,N-diethyl-4-(2,2,2-trifluoroethylamino)pyridine-2-carboxamide
CID 43517418
4-(1-aminopropan-2-ylamino)-N,N-diethylpyridine-2-carboxamide
CID 55228575
N,N-diethyl-4-(pent-1-yn-3-ylamino)pyridine-2-carboxamide
CID 106231329
N,N-diethyl-4-[(2-hydroxy-2-methylpentyl)amino]pyridine-2-carboxamide
CID 106290832
4-[(3-amino-2,2-difluoropropyl)amino]-N,N-diethylpyridine-2-carboxamide
CID 114384362
4-(2-hydroxypropylamino)-N,N-dimethylpyridine-2-carboxamide
CID 43395771
N-ethyl-N-(2-hydroxy-2-methylpropyl)-4-(propylamino)pyridine-2-carboxamide
CID 79386430

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide?
The IUPAC name of N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide (CID 62693747) is N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide.
What is the SMILES notation for N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide?
The canonical SMILES for N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide is CCC(C)CNc1ccnc(C(=O)N(CC)CC)c1.
What is the InChIKey of N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide?
The InChIKey is YWPVBSLTEUSKBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-12(4)11-17-13-8-9-16-14(10-13)15(19)18(6-2)7-3/h8-10,12H,5-7,11H2,1-4H3,(H,16,17).
What are the key properties of N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide?
N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide has a molecular weight of 263.38 g/mol, XLogP of 3.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-(2-methylbutylamino)pyridine-2-carboxamide is sourced from PubChem (CID 62693747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).