2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide

C12H19N3O — CID 60848389

IUPAC2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide
SMILESCCCC(C)(N)C(=O)NCc1cccnc1
InChIInChI=1S/C12H19N3O/c1-3-6-12(2,13)11(16)15-9-10-5-4-7-14-8-10/h4-5,7-8H,3,6,9,13H2,1-2H3,(H,15,16)
InChIKeyHMGMZCBWBWGICA-UHFFFAOYSA-N
MW221.30 g/mol
LogP1.22
Rot. Bonds5

About 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide

2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide (PubChem CID 60848389) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide
PubChem CID60848389
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide
SMILESCCCC(C)(N)C(=O)NCc1cccnc1
InChIInChI=1S/C12H19N3O/c1-3-6-12(2,13)11(16)15-9-10-5-4-7-14-8-10/h4-5,7-8H,3,6,9,13H2,1-2H3,(H,15,16)
InChIKeyHMGMZCBWBWGICA-UHFFFAOYSA-N
XLogP1.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-3-methyl-1-pyridin-3-ylhexan-2-one
CID 116557063
2-amino-2-phenyl-N-(pyridin-3-ylmethyl)propanamide
CID 55078393
N-butyl-2,2-dimethyl-N'-(pyridin-3-ylmethyl)propanediamide
CID 108957797
2-amino-2-methyl-N-(pyridazin-3-ylmethyl)pentanamide
CID 106896146
2-amino-N-[[3-(hydroxymethyl)phenyl]methyl]-2-methylpentanamide;hydrochloride
CID 119775504
2-amino-2-methyl-1-pyridin-3-ylpentan-1-one
CID 116557032
3-amino-3-hydroxyimino-2,2-dimethyl-N-(pyridin-3-ylmethyl)propanamide
CID 76920376
3-amino-2-(4-fluorophenyl)-2-methyl-N-(pyridin-3-ylmethyl)propanamide
CID 155040377
2-methyl-2-phenoxy-N-(pyridin-3-ylmethyl)propanamide
CID 30307775
3-[[(2-amino-2-methylpentanoyl)amino]methyl]-N-ethylbenzamide
CID 119734851
2-amino-2-methyl-N-[[3-(methylsulfonylmethyl)phenyl]methyl]pentanamide
CID 119757053
N-[(4-acetamidophenyl)methyl]-2-amino-2-methylpentanamide
CID 61258515

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide?
The IUPAC name of 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide (CID 60848389) is 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide?
The canonical SMILES for 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide is CCCC(C)(N)C(=O)NCc1cccnc1.
What is the InChIKey of 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide?
The InChIKey is HMGMZCBWBWGICA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O/c1-3-6-12(2,13)11(16)15-9-10-5-4-7-14-8-10/h4-5,7-8H,3,6,9,13H2,1-2H3,(H,15,16).
What are the key properties of 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide?
2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide has a molecular weight of 221.30 g/mol, XLogP of 1.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(pyridin-3-ylmethyl)pentanamide is sourced from PubChem (CID 60848389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).