2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide

C12H24N2O2 — CID 107418374

IUPAC2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide
SMILESCOCCC(N)C(=O)NCC1CCCC1C
InChIInChI=1S/C12H24N2O2/c1-9-4-3-5-10(9)8-14-12(15)11(13)6-7-16-2/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyDOUJBHWBLMKYNC-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.90
Rot. Bonds6

About 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide

2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide (PubChem CID 107418374) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide.

Molecular Properties

Compound Name2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide
PubChem CID107418374
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide
SMILESCOCCC(N)C(=O)NCC1CCCC1C
InChIInChI=1S/C12H24N2O2/c1-9-4-3-5-10(9)8-14-12(15)11(13)6-7-16-2/h9-11H,3-8,13H2,1-2H3,(H,14,15)
InChIKeyDOUJBHWBLMKYNC-UHFFFAOYSA-N
XLogP0.90
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide 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

(2S)-2-amino-N-[(2-methylcyclopentyl)methyl]propanamide
CID 107418588
2-amino-N-[(2-methylcyclohexyl)methyl]-4-methylsulfonylbutanamide
CID 55012024
2-amino-4-methoxy-N-(7-oxabicyclo[2.2.1]heptan-2-ylmethyl)butanamide
CID 114267337
2-amino-N-(cyclobutylmethyl)-3-methoxypropanamide
CID 81080963
2-amino-4-methoxy-N-(oxolan-2-ylmethyl)butanamide
CID 62472979
2-amino-4-methoxy-N-[(1-methylpiperidin-3-yl)methyl]butanamide
CID 62475604
2-amino-4-methoxy-N-(oxan-3-ylmethyl)butanamide
CID 62473603
(2-methylcyclopentyl)methylurea
CID 107417745
2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methoxybutanamide
CID 83021863
4-amino-N-[(2-methylcyclopentyl)methyl]pentanamide
CID 107418378
2-amino-N-[(4-hydroxycyclohexyl)methyl]-5-methoxypentanamide
CID 106135403
2-amino-N-(3-amino-3-oxopropyl)-4-methoxybutanamide
CID 62473721

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide?
The IUPAC name of 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide (CID 107418374) is 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide.
What is the SMILES notation for 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide?
The canonical SMILES for 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide is COCCC(N)C(=O)NCC1CCCC1C.
What is the InChIKey of 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide?
The InChIKey is DOUJBHWBLMKYNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-9-4-3-5-10(9)8-14-12(15)11(13)6-7-16-2/h9-11H,3-8,13H2,1-2H3,(H,14,15).
What are the key properties of 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide?
2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide has a molecular weight of 228.34 g/mol, XLogP of 0.90, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methoxy-N-[(2-methylcyclopentyl)methyl]butanamide is sourced from PubChem (CID 107418374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).