N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide

C14H23N3O2 — CID 79667847

IUPACN-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide
SMILESCCCN(CC(C)(C)CN)C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C14H23N3O2/c1-4-7-17(10-14(2,3)9-15)13(19)11-5-6-12(18)16-8-11/h5-6,8H,4,7,9-10,15H2,1-3H3,(H,16,18)
InChIKeyCTCWHVJIUSKFJD-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.21
Rot. Bonds6

About N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide

N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide (PubChem CID 79667847) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide
PubChem CID79667847
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide
SMILESCCCN(CC(C)(C)CN)C(=O)c1ccc(=O)[nH]c1
InChIInChI=1S/C14H23N3O2/c1-4-7-17(10-14(2,3)9-15)13(19)11-5-6-12(18)16-8-11/h5-6,8H,4,7,9-10,15H2,1-3H3,(H,16,18)
InChIKeyCTCWHVJIUSKFJD-UHFFFAOYSA-N
XLogP1.21
TPSA79.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-oxo-N-propyl-N-(2,2,2-trifluoroethyl)-1H-pyridine-3-carboxamide
CID 60778275
N-(3-amino-2,2-dimethylpropyl)-N-methyl-6-oxo-1H-pyridine-3-carboxamide
CID 79652401
N-(3-amino-2,2-dimethylpropyl)-4-methoxy-N-propylbenzamide
CID 79667923
N-(3-amino-2,2-dimethylpropyl)-4-hydroxy-3-methyl-N-propylbenzamide
CID 107672177
N-(3-amino-2,2-dimethylpropyl)-3,5-dichloro-N-propylbenzamide
CID 79668340
N-(3-amino-2,2-dimethylpropyl)-2,4-dioxo-N-propyl-1H-pyrimidine-5-carboxamide
CID 79667775
N-(3-amino-2,2-dimethylpropyl)-2-oxo-N-propyl-1H-pyridine-3-carboxamide
CID 79668674
N-(3-amino-2,2-dimethylpropyl)-N-propylpyridazine-4-carboxamide
CID 113439418
N-(3-amino-2,2-dimethylpropyl)-3-chloro-4-fluoro-N-propylbenzamide
CID 82878831
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-hydroxybenzamide
CID 79668244
N-(3-amino-2,2-dimethylpropyl)-2,4-dimethyl-N-propylbenzamide
CID 79667849
N-(3-amino-2,2-dimethylpropyl)-5-chloro-N-propylfuran-2-carboxamide
CID 79667920

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide?
The IUPAC name of N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide (CID 79667847) is N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide is CCCN(CC(C)(C)CN)C(=O)c1ccc(=O)[nH]c1.
What is the InChIKey of N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide?
The InChIKey is CTCWHVJIUSKFJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-4-7-17(10-14(2,3)9-15)13(19)11-5-6-12(18)16-8-11/h5-6,8H,4,7,9-10,15H2,1-3H3,(H,16,18).
What are the key properties of N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide?
N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 1.21, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-dimethylpropyl)-6-oxo-N-propyl-1H-pyridine-3-carboxamide is sourced from PubChem (CID 79667847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).