N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide

C10H18N2O — CID 62268451

IUPACN-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide
SMILESNCCCNC(=O)CC1C=CCC1
InChIInChI=1S/C10H18N2O/c11-6-3-7-12-10(13)8-9-4-1-2-5-9/h1,4,9H,2-3,5-8,11H2,(H,12,13)
InChIKeyRCMFFCQPHUNOFS-UHFFFAOYSA-N
MW182.27 g/mol
LogP0.81
Rot. Bonds5

About N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide

N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide (PubChem CID 62268451) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide
PubChem CID62268451
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC NameN-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide
SMILESNCCCNC(=O)CC1C=CCC1
InChIInChI=1S/C10H18N2O/c11-6-3-7-12-10(13)8-9-4-1-2-5-9/h1,4,9H,2-3,5-8,11H2,(H,12,13)
InChIKeyRCMFFCQPHUNOFS-UHFFFAOYSA-N
XLogP0.81
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-[(2-cyclopent-2-en-1-ylacetyl)amino]ethylsulfanyl]acetic acid
CID 115731474
N-[2-(4-aminocyclohexyl)oxyethyl]-2-cyclopent-2-en-1-ylacetamide
CID 63869968
N-(3-aminopropyl)-2-cyclopentylacetamide
CID 24706958
3-[(2-cyclopent-2-en-1-ylacetyl)amino]-N-(pyridin-4-ylmethyl)propanamide
CID 51106744
N-(2-amino-3-hydroxybutyl)-2-cyclopent-2-en-1-ylacetamide
CID 64539561
2-[(1R)-cyclopent-2-en-1-yl]acetamide
CID 51382690
N-[2-(2-cyano-3-fluoroanilino)ethyl]-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 94139239
2-[(1R)-cyclopent-2-en-1-yl]-N-[[(2R)-thiolan-2-yl]methyl]acetamide
CID 97068704
N-(1-amino-2,3-dimethylbutan-2-yl)-2-cyclopent-2-en-1-ylacetamide
CID 115310441
2-cyclopent-2-en-1-yl-N-(2-hydroxy-2-propylpentyl)acetamide
CID 111444858
2-[(1R)-cyclopent-2-en-1-yl]-N-[(2S)-2-hydroxy-4-methylpentyl]acetamide
CID 97079501
N-(2-aminophenyl)-2-[(1S)-cyclopent-2-en-1-yl]acetamide
CID 51714392

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide?
The IUPAC name of N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide (CID 62268451) is N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide.
What is the SMILES notation for N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide?
The canonical SMILES for N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide is NCCCNC(=O)CC1C=CCC1.
What is the InChIKey of N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide?
The InChIKey is RCMFFCQPHUNOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c11-6-3-7-12-10(13)8-9-4-1-2-5-9/h1,4,9H,2-3,5-8,11H2,(H,12,13).
What are the key properties of N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide?
N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide has a molecular weight of 182.27 g/mol, XLogP of 0.81, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-cyclopent-2-en-1-ylacetamide is sourced from PubChem (CID 62268451), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).