N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide

C15H25N3O2 — CID 56808777

IUPACN-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCCC(CC)C(CNC(=O)c1ccc(=O)[nH]c1)N(C)C
InChIInChI=1S/C15H25N3O2/c1-5-11(6-2)13(18(3)4)10-17-15(20)12-7-8-14(19)16-9-12/h7-9,11,13H,5-6,10H2,1-4H3,(H,16,19)(H,17,20)
InChIKeyFOMFCZUNOLXYRW-UHFFFAOYSA-N
MW279.38 g/mol
LogP1.47
Rot. Bonds7

About N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide

N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 56808777) has the molecular formula C15H25N3O2 and a molecular weight of 279.38 g/mol. Its IUPAC name is N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID56808777
Molecular FormulaC15H25N3O2
Molecular Weight279.38 g/mol
Exact Mass279.19
IUPAC NameN-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCCC(CC)C(CNC(=O)c1ccc(=O)[nH]c1)N(C)C
InChIInChI=1S/C15H25N3O2/c1-5-11(6-2)13(18(3)4)10-17-15(20)12-7-8-14(19)16-9-12/h7-9,11,13H,5-6,10H2,1-4H3,(H,16,19)(H,17,20)
InChIKeyFOMFCZUNOLXYRW-UHFFFAOYSA-N
XLogP1.47
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-6-oxo-1H-pyridine-3-carboxamide
CID 2456191
(4-Aminopiperidin-1-yl)(6-hydroxypyridin-3-yl)methanone
CID 43556202
N-[1-(cyclopentylamino)-2-methyl-1-oxobutan-2-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 4076919
N-({1-[(2E)-2-methylpent-2-en-1-yl]piperidin-4-yl}methyl)-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 56710306
N-[rel-(3R,4S)-1-(cyclobutylmethyl)-4-isopropyl-3-pyrrolidinyl]-6-oxo-1,6-dihydro-3-pyridinecarboxamide hydrochloride
CID 72847325
1-methyl-6-oxidanylidene-~{N}-(2-pyrrolidin-1-ylethyl)pyridine-3-carboxamide
CID 126802784
N-(2-aminoethyl)-1-methyl-6-oxopyridine-3-carboxamide
CID 126810764
N-[(1-aminocyclohexyl)methyl]-1-methyl-6-oxopyridine-3-carboxamide
CID 126814239
(3R)-3-[(2R)-butan-2-yl]-4-methyl-2,3-dihydropyrrolo[3,4-b]quinoline-1,6-dione
CID 10061683
(3S)-3-[(2R)-butan-2-yl]-4-methyl-2,3-dihydropyrrolo[3,4-b]quinoline-1,6-dione
CID 10378435
(3R)-3-[(2S)-butan-2-yl]-4-methyl-2,3-dihydropyrrolo[3,4-b]quinoline-1,6-dione
CID 163194998
N-[1-(cyclohexylamino)-2-methyl-1-oxobutan-2-yl]-6-oxo-1H-pyridine-3-carboxamide
CID 3352169

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide (CID 56808777) is N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide is CCC(CC)C(CNC(=O)c1ccc(=O)[nH]c1)N(C)C.
What is the InChIKey of N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is FOMFCZUNOLXYRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O2/c1-5-11(6-2)13(18(3)4)10-17-15(20)12-7-8-14(19)16-9-12/h7-9,11,13H,5-6,10H2,1-4H3,(H,16,19)(H,17,20).
What are the key properties of N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide?
N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 279.38 g/mol, XLogP of 1.47, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-3-ethylpentyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 56808777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).