4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide

C10H18N2O3 — CID 79207720

IUPAC4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide
SMILESCOCC(O)CNC(=O)C1C=CC(N)C1
InChIInChI=1S/C10H18N2O3/c1-15-6-9(13)5-12-10(14)7-2-3-8(11)4-7/h2-3,7-9,13H,4-6,11H2,1H3,(H,12,14)
InChIKeyJFOQZWPUBFZNLQ-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.99
Rot. Bonds5

About 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide

4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide (PubChem CID 79207720) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide
PubChem CID79207720
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide
SMILESCOCC(O)CNC(=O)C1C=CC(N)C1
InChIInChI=1S/C10H18N2O3/c1-15-6-9(13)5-12-10(14)7-2-3-8(11)4-7/h2-3,7-9,13H,4-6,11H2,1H3,(H,12,14)
InChIKeyJFOQZWPUBFZNLQ-UHFFFAOYSA-N
XLogP-0.99
TPSA84.58 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.99
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide 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

3-[(4-aminocyclopent-2-ene-1-carbonyl)amino]-2-methoxypropanoic acid
CID 106109009
2-[(4-aminocyclopent-2-ene-1-carbonyl)amino]-3-methoxypropanoic acid
CID 81078810
4-amino-N-ethylcyclopent-2-ene-1-carboxamide
CID 79211546
4-amino-N-(4-propan-2-yloxybutyl)cyclopent-2-ene-1-carboxamide
CID 114137040
4-amino-N-(2-aminoethyl)cyclopent-2-ene-1-carboxamide
CID 79207691
methyl (1S)-4-aminocyclopent-2-ene-1-carboxylate
CID 89349898
4-amino-N-(1,1-dimethoxypropan-2-yl)cyclopent-2-ene-1-carboxamide
CID 79207526
4-amino-N-pentylcyclopent-2-ene-1-carboxamide
CID 79211552
methyl 4-aminocyclopent-2-ene-1-carboxylate;hydrochloride
CID 18538082
4-amino-N-(3-methylsulfanylpropyl)cyclopent-2-ene-1-carboxamide
CID 79207622
4-amino-N-pentan-2-ylcyclopent-2-ene-1-carboxamide
CID 79211383
4-amino-N-(2,2-difluoro-3-hydroxypropyl)cyclopent-2-ene-1-carboxamide
CID 106176733

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide?
The IUPAC name of 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide (CID 79207720) is 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide.
What is the SMILES notation for 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide?
The canonical SMILES for 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide is COCC(O)CNC(=O)C1C=CC(N)C1.
What is the InChIKey of 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide?
The InChIKey is JFOQZWPUBFZNLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-15-6-9(13)5-12-10(14)7-2-3-8(11)4-7/h2-3,7-9,13H,4-6,11H2,1H3,(H,12,14).
What are the key properties of 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide?
4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide has a molecular weight of 214.26 g/mol, XLogP of -0.99, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-hydroxy-3-methoxypropyl)cyclopent-2-ene-1-carboxamide is sourced from PubChem (CID 79207720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).