(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide

C11H17N3O — CID 107570953

IUPAC(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide
SMILESCCC[C@H](N)C(=O)N(C)c1ccncc1
InChIInChI=1S/C11H17N3O/c1-3-4-10(12)11(15)14(2)9-5-7-13-8-6-9/h5-8,10H,3-4,12H2,1-2H3/t10-/m0/s1
InChIKeyVEJAKVUWYPPGGY-JTQLQIEISA-N
MW207.28 g/mol
LogP1.17
Rot. Bonds4

About (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide

(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide (PubChem CID 107570953) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide
PubChem CID107570953
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide
SMILESCCC[C@H](N)C(=O)N(C)c1ccncc1
InChIInChI=1S/C11H17N3O/c1-3-4-10(12)11(15)14(2)9-5-7-13-8-6-9/h5-8,10H,3-4,12H2,1-2H3/t10-/m0/s1
InChIKeyVEJAKVUWYPPGGY-JTQLQIEISA-N
XLogP1.17
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N,3-dimethyl-N-pyridin-4-ylpentanamide
CID 106935125
(2R)-2-amino-3-(4-hydroxyphenyl)-N-methyl-N-pyridin-4-ylpropanamide
CID 106935047
2-amino-N-(3,5-dimethylphenyl)-N-methylpentanamide
CID 103628440
(2R)-2-amino-N-methyl-N-(3-methylphenyl)pentanamide
CID 103794882
2-amino-N-ethyl-N-(pyridin-4-ylmethyl)pentanamide
CID 54873793
(2S)-2-amino-N-methyl-N-(1-pyridin-4-ylethyl)hexanamide
CID 113357165
N-methyl-N-pyridin-4-ylpropanamide
CID 59710602
2-bromo-N,3-dimethyl-N-pyridin-4-ylbutanamide
CID 106934733
2-amino-N-(4-hydroxyphenyl)-N-methylbutanamide
CID 107734416
(2R)-2-amino-N-hydroxy-N-methylpentanamide
CID 131057070
methyl(pyridin-4-yl)carbamic acid
CID 54205463
(2R)-2-amino-N-ethyl-N-pyridin-4-ylpropanamide
CID 106935605

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide?
The IUPAC name of (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide (CID 107570953) is (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide.
What is the SMILES notation for (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide?
The canonical SMILES for (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide is CCC[C@H](N)C(=O)N(C)c1ccncc1.
What is the InChIKey of (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide?
The InChIKey is VEJAKVUWYPPGGY-JTQLQIEISA-N. The full InChI is InChI=1S/C11H17N3O/c1-3-4-10(12)11(15)14(2)9-5-7-13-8-6-9/h5-8,10H,3-4,12H2,1-2H3/t10-/m0/s1.
What are the key properties of (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide?
(2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide has a molecular weight of 207.28 g/mol, XLogP of 1.17, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-methyl-N-pyridin-4-ylpentanamide is sourced from PubChem (CID 107570953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).