(2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide

C14H23N3O2 — CID 126429050

IUPAC(2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide
SMILESCOCC1(NC(=O)[C@H](C)n2ccnc2C)CCCC1
InChIInChI=1S/C14H23N3O2/c1-11(17-9-8-15-12(17)2)13(18)16-14(10-19-3)6-4-5-7-14/h8-9,11H,4-7,10H2,1-3H3,(H,16,18)/t11-/m0/s1
InChIKeyVDNKPHQDGAPPKP-NSHDSACASA-N
MW265.36 g/mol
LogP1.83
Rot. Bonds5

About (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide

(2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide (PubChem CID 126429050) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide.

Molecular Properties

Compound Name(2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide
PubChem CID126429050
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC Name(2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide
SMILESCOCC1(NC(=O)[C@H](C)n2ccnc2C)CCCC1
InChIInChI=1S/C14H23N3O2/c1-11(17-9-8-15-12(17)2)13(18)16-14(10-19-3)6-4-5-7-14/h8-9,11H,4-7,10H2,1-3H3,(H,16,18)/t11-/m0/s1
InChIKeyVDNKPHQDGAPPKP-NSHDSACASA-N
XLogP1.83
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide?
The IUPAC name of (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide (CID 126429050) is (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide.
What is the SMILES notation for (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide?
The canonical SMILES for (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide is COCC1(NC(=O)[C@H](C)n2ccnc2C)CCCC1.
What is the InChIKey of (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide?
The InChIKey is VDNKPHQDGAPPKP-NSHDSACASA-N. The full InChI is InChI=1S/C14H23N3O2/c1-11(17-9-8-15-12(17)2)13(18)16-14(10-19-3)6-4-5-7-14/h8-9,11H,4-7,10H2,1-3H3,(H,16,18)/t11-/m0/s1.
What are the key properties of (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide?
(2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide has a molecular weight of 265.36 g/mol, XLogP of 1.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[1-(methoxymethyl)cyclopentyl]-2-(2-methylimidazol-1-yl)propanamide is sourced from PubChem (CID 126429050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).