2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide

C9H20N2O3 — CID 81082818

IUPAC2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide
SMILESCOCCCC(N)C(=O)N(C)CCO
InChIInChI=1S/C9H20N2O3/c1-11(5-6-12)9(13)8(10)4-3-7-14-2/h8,12H,3-7,10H2,1-2H3
InChIKeyBRCXAGJQPHBTNF-UHFFFAOYSA-N
MW204.27 g/mol
LogP-0.81
Rot. Bonds7

About 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide

2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide (PubChem CID 81082818) has the molecular formula C9H20N2O3 and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide.

Molecular Properties

Compound Name2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide
PubChem CID81082818
Molecular FormulaC9H20N2O3
Molecular Weight204.27 g/mol
Exact Mass204.15
IUPAC Name2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide
SMILESCOCCCC(N)C(=O)N(C)CCO
InChIInChI=1S/C9H20N2O3/c1-11(5-6-12)9(13)8(10)4-3-7-14-2/h8,12H,3-7,10H2,1-2H3
InChIKeyBRCXAGJQPHBTNF-UHFFFAOYSA-N
XLogP-0.81
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide 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-(3-methoxypropyl)-N-methylpentanamide
CID 81088448
2-amino-5-methoxy-N-methyl-N-pentylpentanamide
CID 81082325
2-amino-N-ethyl-N-(2-hydroxyethyl)-5-methoxypentanamide
CID 81082966
2-amino-N-(3-methoxypropyl)-N-methylbutanamide
CID 63010217
(2S)-2-amino-N-(3-methoxypropyl)-N-methylbutanamide
CID 79023136
2-amino-N-(3-methoxypropyl)-N-methylpropanamide
CID 63010028
2-[(2-amino-5-methoxypentanoyl)-methylamino]-2-methylpropanoic acid
CID 81088551
2-amino-5-methoxy-N-propan-2-yl-N-propylpentanamide
CID 81081647
2-amino-N-butan-2-yl-5-methoxy-N-(2-methoxyethyl)pentanamide
CID 81088100
2-amino-N-[(3-hydroxycyclobutyl)methyl]-5-methoxy-N-methylpentanamide
CID 81101474
3-amino-1,6-dimethoxyhexan-2-one
CID 116593700
2-amino-5-methoxypentanoic acid
CID 18361135

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide?
The IUPAC name of 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide (CID 81082818) is 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide.
What is the SMILES notation for 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide?
The canonical SMILES for 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide is COCCCC(N)C(=O)N(C)CCO.
What is the InChIKey of 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide?
The InChIKey is BRCXAGJQPHBTNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O3/c1-11(5-6-12)9(13)8(10)4-3-7-14-2/h8,12H,3-7,10H2,1-2H3.
What are the key properties of 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide?
2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide has a molecular weight of 204.27 g/mol, XLogP of -0.81, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-hydroxyethyl)-5-methoxy-N-methylpentanamide is sourced from PubChem (CID 81082818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).