(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide

C9H15N3O2 — CID 94893498

IUPAC(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide
SMILESCC(C)C[C@@H](N)C(=O)Nc1cnoc1
InChIInChI=1S/C9H15N3O2/c1-6(2)3-8(10)9(13)12-7-4-11-14-5-7/h4-6,8H,3,10H2,1-2H3,(H,12,13)/t8-/m1/s1
InChIKeyIAOAVSKHQBXKMW-MRVPVSSYSA-N
MW197.24 g/mol
LogP0.99
Rot. Bonds4

About (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide

(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide (PubChem CID 94893498) has the molecular formula C9H15N3O2 and a molecular weight of 197.24 g/mol. Its IUPAC name is (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide
PubChem CID94893498
Molecular FormulaC9H15N3O2
Molecular Weight197.24 g/mol
Exact Mass197.12
IUPAC Name(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide
SMILESCC(C)C[C@@H](N)C(=O)Nc1cnoc1
InChIInChI=1S/C9H15N3O2/c1-6(2)3-8(10)9(13)12-7-4-11-14-5-7/h4-6,8H,3,10H2,1-2H3,(H,12,13)/t8-/m1/s1
InChIKeyIAOAVSKHQBXKMW-MRVPVSSYSA-N
XLogP0.99
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-amino-3-methyl-N-(1,2-oxazol-4-yl)butanamide
CID 79013276
(2S)-2-amino-4-methyl-N-pyrimidin-5-ylpentanamide
CID 107588618
(2S)-2-amino-3-cyclopentyl-N-(1,2-oxazol-4-yl)propanamide
CID 177043206
(2R)-2-amino-4-methyl-N-(1H-pyrazol-4-yl)pentanamide
CID 83618000
(2R)-2-amino-4-methyl-N-(1-methylpyrazol-4-yl)pentanamide
CID 93104460
2-amino-N-(4-hydroxyphenyl)-4-methylpentanamide
CID 22768242
2-amino-4-methyl-N-(4-propan-2-ylphenyl)pentanamide
CID 24696711
5-[(2-amino-4-methylpentanoyl)amino]benzene-1,3-dicarboxylic acid
CID 61162411
(2S)-2-amino-N-[4-[[2-(dimethylamino)acetyl]amino]phenyl]-4-methylpentanamide
CID 119885345
(2R)-2-amino-N-[4-[hydroxy(oxido)amino]phenyl]-4-methylpentanamide
CID 163140404
2-amino-N-(3,5-dibromo-4-hydroxyphenyl)-4-methylpentanamide
CID 13419970
2-amino-2-ethyl-N-(1,2-oxazol-4-yl)butanamide
CID 79815107

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide?
The IUPAC name of (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide (CID 94893498) is (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide.
What is the SMILES notation for (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide?
The canonical SMILES for (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide is CC(C)C[C@@H](N)C(=O)Nc1cnoc1.
What is the InChIKey of (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide?
The InChIKey is IAOAVSKHQBXKMW-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H15N3O2/c1-6(2)3-8(10)9(13)12-7-4-11-14-5-7/h4-6,8H,3,10H2,1-2H3,(H,12,13)/t8-/m1/s1.
What are the key properties of (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide?
(2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide has a molecular weight of 197.24 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-4-methyl-N-(1,2-oxazol-4-yl)pentanamide is sourced from PubChem (CID 94893498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).