2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide

C11H24N2O3 — CID 81100884

IUPAC2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)N[C@H](CO)C(C)C
InChIInChI=1S/C11H24N2O3/c1-8(2)10(7-14)13-11(15)9(12)5-4-6-16-3/h8-10,14H,4-7,12H2,1-3H3,(H,13,15)/t9?,10-/m1/s1
InChIKeyBFHKXLZBPMOOGB-QVDQXJPCSA-N
MW232.32 g/mol
LogP-0.13
Rot. Bonds8

About 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide

2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide (PubChem CID 81100884) has the molecular formula C11H24N2O3 and a molecular weight of 232.32 g/mol. Its IUPAC name is 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide.

Molecular Properties

Compound Name2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide
PubChem CID81100884
Molecular FormulaC11H24N2O3
Molecular Weight232.32 g/mol
Exact Mass232.18
IUPAC Name2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide
SMILESCOCCCC(N)C(=O)N[C@H](CO)C(C)C
InChIInChI=1S/C11H24N2O3/c1-8(2)10(7-14)13-11(15)9(12)5-4-6-16-3/h8-10,14H,4-7,12H2,1-3H3,(H,13,15)/t9?,10-/m1/s1
InChIKeyBFHKXLZBPMOOGB-QVDQXJPCSA-N
XLogP-0.13
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-5-methoxy-N-(1-methoxy-3-methylbutan-2-yl)pentanamide
CID 81101222
2-amino-4-methoxy-N-(1-methoxy-3-methylbutan-2-yl)butanamide
CID 65049176
2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]pentanamide
CID 79249157
2-amino-5-methoxy-N-octan-2-ylpentanamide
CID 81083239
2-amino-5-methoxy-N-(3-methoxypropyl)pentanamide
CID 81081158
2-amino-3-methoxy-N-(1-methoxy-3-methylbutan-2-yl)propanamide
CID 81101107
2-amino-5-methoxy-N-octan-4-ylpentanamide
CID 114138350
4-amino-5-[(1-methoxy-3-methylbutan-2-yl)amino]-5-oxopentanoic acid
CID 65049349
2-amino-5-methoxy-N-(4-methylpentyl)pentanamide
CID 81089350
(2R)-2-amino-N-(1-methoxy-3-methylbutan-2-yl)-4-methylsulfanylbutanamide
CID 104908600
2-amino-5-methoxy-N-propylpentanamide
CID 81082005
(2S)-2-[(2-amino-5-methoxypentanoyl)amino]-4-methoxy-4-oxobutanoic acid
CID 81088787

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide?
The IUPAC name of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide (CID 81100884) is 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide.
What is the SMILES notation for 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide?
The canonical SMILES for 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide is COCCCC(N)C(=O)N[C@H](CO)C(C)C.
What is the InChIKey of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide?
The InChIKey is BFHKXLZBPMOOGB-QVDQXJPCSA-N. The full InChI is InChI=1S/C11H24N2O3/c1-8(2)10(7-14)13-11(15)9(12)5-4-6-16-3/h8-10,14H,4-7,12H2,1-3H3,(H,13,15)/t9?,10-/m1/s1.
What are the key properties of 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide?
2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide has a molecular weight of 232.32 g/mol, XLogP of -0.13, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-5-methoxypentanamide is sourced from PubChem (CID 81100884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).