N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide

C13H22N2O — CID 74343730

IUPACN-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide
SMILESC=CCN(CC=C)C1CCCC1NC(C)=O
InChIInChI=1S/C13H22N2O/c1-4-9-15(10-5-2)13-8-6-7-12(13)14-11(3)16/h4-5,12-13H,1-2,6-10H2,3H3,(H,14,16)
InChIKeyOGZUCPLDTTVSQA-UHFFFAOYSA-N
MW222.33 g/mol
LogP1.72
Rot. Bonds6

About N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide

N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide (PubChem CID 74343730) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide.

Molecular Properties

Compound NameN-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide
PubChem CID74343730
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC NameN-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide
SMILESC=CCN(CC=C)C1CCCC1NC(C)=O
InChIInChI=1S/C13H22N2O/c1-4-9-15(10-5-2)13-8-6-7-12(13)14-11(3)16/h4-5,12-13H,1-2,6-10H2,3H3,(H,14,16)
InChIKeyOGZUCPLDTTVSQA-UHFFFAOYSA-N
XLogP1.72
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide?
The IUPAC name of N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide (CID 74343730) is N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide.
What is the SMILES notation for N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide?
The canonical SMILES for N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide is C=CCN(CC=C)C1CCCC1NC(C)=O.
What is the InChIKey of N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide?
The InChIKey is OGZUCPLDTTVSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-4-9-15(10-5-2)13-8-6-7-12(13)14-11(3)16/h4-5,12-13H,1-2,6-10H2,3H3,(H,14,16).
What are the key properties of N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide?
N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide has a molecular weight of 222.33 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[bis(prop-2-enyl)amino]cyclopentyl]acetamide is sourced from PubChem (CID 74343730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).