2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide

C10H22N2O2 — CID 43500021

IUPAC2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
SMILESCCC(CO)NC(=O)C(N)CC(C)C
InChIInChI=1S/C10H22N2O2/c1-4-8(6-13)12-10(14)9(11)5-7(2)3/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)
InChIKeyXNJHFGLZUFSNQR-UHFFFAOYSA-N
MW202.30 g/mol
LogP0.25
Rot. Bonds6

About 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide

2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide (PubChem CID 43500021) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
PubChem CID43500021
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC Name2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
SMILESCCC(CO)NC(=O)C(N)CC(C)C
InChIInChI=1S/C10H22N2O2/c1-4-8(6-13)12-10(14)9(11)5-7(2)3/h7-9,13H,4-6,11H2,1-3H3,(H,12,14)
InChIKeyXNJHFGLZUFSNQR-UHFFFAOYSA-N
XLogP0.25
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 50.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-4-[[(2S)-1-hydroxybutan-2-yl]amino]-4-oxobutanoic acid
CID 107222531
(2S)-2-amino-4-methyl-N-(1-methylsulfanylbutan-2-yl)pentanamide
CID 103951305
2-amino-N-[(2S)-1-hydroxybutan-2-yl]pentanamide
CID 107222375
(2S)-2-amino-N-[(2S)-1-hydroxybutan-2-yl]pentanamide
CID 107571000
2-amino-N-(1,3-dihydroxypropan-2-yl)butanamide
CID 65314270
2-(carbamoylamino)-N-(1-hydroxybutan-2-yl)-4-methylpentanamide
CID 43428008
2-(carbamoylamino)-N-[(2R)-1-hydroxybutan-2-yl]-4-methylpentanamide
CID 113498876
2-ethyl-N-(1-hydroxy-4-methylpentan-2-yl)butanamide
CID 61246170
(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-hydroxypropanoic acid;hydrochloride
CID 122235943
(2S)-2-amino-N-(1-hydroxybutan-2-yl)hexanamide
CID 107143870
N-[(2R)-1-hydroxybutan-2-yl]-2-methylbutanamide
CID 103919845
(2S)-2-amino-N-[(2S)-1-hydroxybutan-2-yl]-3-methylpentanamide
CID 107222401

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide?
The IUPAC name of 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide (CID 43500021) is 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide.
What is the SMILES notation for 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide?
The canonical SMILES for 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide is CCC(CO)NC(=O)C(N)CC(C)C.
What is the InChIKey of 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide?
The InChIKey is XNJHFGLZUFSNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O2/c1-4-8(6-13)12-10(14)9(11)5-7(2)3/h7-9,13H,4-6,11H2,1-3H3,(H,12,14).
What are the key properties of 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide?
2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide has a molecular weight of 202.30 g/mol, XLogP of 0.25, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-hydroxybutan-2-yl)-4-methylpentanamide is sourced from PubChem (CID 43500021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).