(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide

C12H19N3O — CID 104903679

IUPAC(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide
SMILESCc1ncccc1NC(=O)[C@H](N)CC(C)C
InChIInChI=1S/C12H19N3O/c1-8(2)7-10(13)12(16)15-11-5-4-6-14-9(11)3/h4-6,8,10H,7,13H2,1-3H3,(H,15,16)/t10-/m1/s1
InChIKeyCTXNDBVRBSSDES-SNVBAGLBSA-N
MW221.30 g/mol
LogP1.70
Rot. Bonds4

About (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide

(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide (PubChem CID 104903679) has the molecular formula C12H19N3O and a molecular weight of 221.30 g/mol. Its IUPAC name is (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide
PubChem CID104903679
Molecular FormulaC12H19N3O
Molecular Weight221.30 g/mol
Exact Mass221.15
IUPAC Name(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide
SMILESCc1ncccc1NC(=O)[C@H](N)CC(C)C
InChIInChI=1S/C12H19N3O/c1-8(2)7-10(13)12(16)15-11-5-4-6-14-9(11)3/h4-6,8,10H,7,13H2,1-3H3,(H,15,16)/t10-/m1/s1
InChIKeyCTXNDBVRBSSDES-SNVBAGLBSA-N
XLogP1.70
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 61178380
2-amino-N-(2-ethoxy-3-pyridinyl)-4-methylpentanamide
CID 43706630
4-amino-5-[(2-methyl-3-pyridinyl)amino]-5-oxopentanoic acid
CID 79043536
(2S)-2-amino-N-(2-methyl-3-pyridinyl)-3-phenylpropanamide
CID 54173969
(2S)-2-amino-4-methyl-N-(2-methylphenyl)pentanamide
CID 22691032
2-amino-3-methyl-N-(2-methyl-3-pyridinyl)pentanamide
CID 79043807
2-amino-4-methyl-N-(2-pyrazol-1-yl-3-pyridinyl)pentanamide
CID 43714222
(2S)-2-amino-4-methyl-N-(2-methylphenyl)pentanamide;hydrochloride
CID 119670479
(2S)-N-(3-acetamido-2-methylphenyl)-2-amino-4-methylpentanamide
CID 119704819
(2R)-2-amino-3,3-dimethyl-N-(2-methyl-3-pyridinyl)butanamide
CID 103930147
2-amino-4-methyl-N-(2-propan-2-ylphenyl)pentanamide
CID 24703772
(2S)-2-amino-3,3-dimethyl-N-(2-methyl-3-pyridinyl)butanamide;dihydrochloride
CID 119844518

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide?
The IUPAC name of (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide (CID 104903679) is (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide.
What is the SMILES notation for (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide?
The canonical SMILES for (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide is Cc1ncccc1NC(=O)[C@H](N)CC(C)C.
What is the InChIKey of (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide?
The InChIKey is CTXNDBVRBSSDES-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H19N3O/c1-8(2)7-10(13)12(16)15-11-5-4-6-14-9(11)3/h4-6,8,10H,7,13H2,1-3H3,(H,15,16)/t10-/m1/s1.
What are the key properties of (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide?
(2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide has a molecular weight of 221.30 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-methyl-N-(2-methyl-3-pyridinyl)pentanamide is sourced from PubChem (CID 104903679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).