2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide

C14H25NO — CID 21366305

IUPAC2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide
SMILESC=CCC(CC1CCCC1)C(=O)NC(C)C
InChIInChI=1S/C14H25NO/c1-4-7-13(14(16)15-11(2)3)10-12-8-5-6-9-12/h4,11-13H,1,5-10H2,2-3H3,(H,15,16)
InChIKeyVIBMUKKPRARESV-UHFFFAOYSA-N
MW223.36 g/mol
LogP3.28
Rot. Bonds6

About 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide

2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide (PubChem CID 21366305) has the molecular formula C14H25NO and a molecular weight of 223.36 g/mol. Its IUPAC name is 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide.

Molecular Properties

Compound Name2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide
PubChem CID21366305
Molecular FormulaC14H25NO
Molecular Weight223.36 g/mol
Exact Mass223.19
IUPAC Name2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide
SMILESC=CCC(CC1CCCC1)C(=O)NC(C)C
InChIInChI=1S/C14H25NO/c1-4-7-13(14(16)15-11(2)3)10-12-8-5-6-9-12/h4,11-13H,1,5-10H2,2-3H3,(H,15,16)
InChIKeyVIBMUKKPRARESV-UHFFFAOYSA-N
XLogP3.28
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide?
The IUPAC name of 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide (CID 21366305) is 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide.
What is the SMILES notation for 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide?
The canonical SMILES for 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide is C=CCC(CC1CCCC1)C(=O)NC(C)C.
What is the InChIKey of 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide?
The InChIKey is VIBMUKKPRARESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO/c1-4-7-13(14(16)15-11(2)3)10-12-8-5-6-9-12/h4,11-13H,1,5-10H2,2-3H3,(H,15,16).
What are the key properties of 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide?
2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide has a molecular weight of 223.36 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylmethyl)-N-propan-2-ylpent-4-enamide is sourced from PubChem (CID 21366305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).