2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide

C9H20N2O2 — CID 61247041

IUPAC2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide
SMILESCC(C)CC(CO)NC(=O)C(C)N
InChIInChI=1S/C9H20N2O2/c1-6(2)4-8(5-12)11-9(13)7(3)10/h6-8,12H,4-5,10H2,1-3H3,(H,11,13)
InChIKeyCJUZKCKAALNBSZ-UHFFFAOYSA-N
MW188.27 g/mol
LogP-0.14
Rot. Bonds5

About 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide

2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide (PubChem CID 61247041) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide.

Molecular Properties

Compound Name2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide
PubChem CID61247041
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Name2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide
SMILESCC(C)CC(CO)NC(=O)C(C)N
InChIInChI=1S/C9H20N2O2/c1-6(2)4-8(5-12)11-9(13)7(3)10/h6-8,12H,4-5,10H2,1-3H3,(H,11,13)
InChIKeyCJUZKCKAALNBSZ-UHFFFAOYSA-N
XLogP-0.14
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 5-0.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide
CID 61245278
(2S)-2-amino-N-(1-hydroxy-4-methylpentan-2-yl)-3-methylpentanamide
CID 61246451
2-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)butanamide
CID 61246170
2-(aminomethyl)-N-(1-hydroxy-4-methylpentan-2-yl)butanamide
CID 65228765
2-aminoacetic acid;(2R)-2-(2-aminopropanoylamino)propanoic acid
CID 88604532
2-[[(2R)-2-aminopropanoyl]amino]-4-methylpentanoic acid
CID 78973229
(2R)-2-[[(2R)-2-aminopropanoyl]amino]-4-methylpentanoic acid
CID 6992390
2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
CID 43500021
N-(1-hydroxy-4-methylpentan-2-yl)-2-propylpentanamide
CID 82987600
2-[[2-[2-(2-aminopropanoylamino)propanoylamino]-3-hydroxypropanoyl]amino]-4-methylpentanoic acid
CID 18232887
(2S)-2-[[(2S)-2-aminopropanoyl]amino]-4-methylpentanoic acid;hydrate
CID 90482817
(2S)-2-amino-N-pentan-3-ylpropanamide
CID 14333664

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide?
The IUPAC name of 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide (CID 61247041) is 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide.
What is the SMILES notation for 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide?
The canonical SMILES for 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide is CC(C)CC(CO)NC(=O)C(C)N.
What is the InChIKey of 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide?
The InChIKey is CJUZKCKAALNBSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2/c1-6(2)4-8(5-12)11-9(13)7(3)10/h6-8,12H,4-5,10H2,1-3H3,(H,11,13).
What are the key properties of 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide?
2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide has a molecular weight of 188.27 g/mol, XLogP of -0.14, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-hydroxy-4-methylpentan-2-yl)propanamide is sourced from PubChem (CID 61247041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).