N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide

C14H23N3O2 — CID 106140544

IUPACN-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCC(C)(C)CCCN)cc1=O
InChIInChI=1S/C14H23N3O2/c1-14(2,6-4-7-15)10-16-13(19)11-5-8-17(3)12(18)9-11/h5,8-9H,4,6-7,10,15H2,1-3H3,(H,16,19)
InChIKeyUGBNFKOMMZVFBC-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.88
Rot. Bonds6

About N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide

N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide (PubChem CID 106140544) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide.

Molecular Properties

Compound NameN-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide
PubChem CID106140544
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide
SMILESCn1ccc(C(=O)NCC(C)(C)CCCN)cc1=O
InChIInChI=1S/C14H23N3O2/c1-14(2,6-4-7-15)10-16-13(19)11-5-8-17(3)12(18)9-11/h5,8-9H,4,6-7,10,15H2,1-3H3,(H,16,19)
InChIKeyUGBNFKOMMZVFBC-UHFFFAOYSA-N
XLogP0.88
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-N-(2-methyl-2-methylsulfanylpropyl)-2-oxopyridine-4-carboxamide
CID 103713487
N-(2-hydroxy-2-propylpentyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 111444713
N-(2-ethyl-2-methylsulfanylbutyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 103709300
N-(2,2-difluoro-3-hydroxypropyl)-1-methyl-2-oxopyridine-4-carboxamide
CID 104857762
N-(5-amino-2,2-dimethylpentyl)-3,4-dimethoxybenzamide
CID 106141080
N-butyl-1-methyl-2-oxopyridine-4-carboxamide
CID 35555679
N-(5-amino-2,2-dimethylpentyl)-4-(dimethylamino)benzamide
CID 106140589
N-(4-amino-2,2-dimethylbutyl)-2-oxo-1H-pyridine-4-carboxamide
CID 106140156
N-(5-amino-2,2-dimethylpentyl)-3-propan-2-yloxybenzamide
CID 106140510
N-(1-chloro-3-methylpentan-3-yl)-1-methyl-2-oxopyridine-4-carboxamide
CID 106168152
1-methyl-N-(3-methylbutyl)-2-oxopyridine-4-carboxamide
CID 35556772
1-methyl-N-(3-methyl-2-oxobutyl)-2-oxopyridine-4-carboxamide
CID 104860744

Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide?
The IUPAC name of N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide (CID 106140544) is N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide.
What is the SMILES notation for N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide?
The canonical SMILES for N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide is Cn1ccc(C(=O)NCC(C)(C)CCCN)cc1=O.
What is the InChIKey of N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide?
The InChIKey is UGBNFKOMMZVFBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-14(2,6-4-7-15)10-16-13(19)11-5-8-17(3)12(18)9-11/h5,8-9H,4,6-7,10,15H2,1-3H3,(H,16,19).
What are the key properties of N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide?
N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.88, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2,2-dimethylpentyl)-1-methyl-2-oxopyridine-4-carboxamide is sourced from PubChem (CID 106140544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).