N-cyclopentyl-N-methylprop-2-enamide

C9H15NO — CID 20727735

IUPACN-cyclopentyl-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)C1CCCC1
InChIInChI=1S/C9H15NO/c1-3-9(11)10(2)8-6-4-5-7-8/h3,8H,1,4-7H2,2H3
InChIKeyBISRKEFEBQIAEE-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.57
Rot. Bonds2

About N-cyclopentyl-N-methylprop-2-enamide

N-cyclopentyl-N-methylprop-2-enamide (PubChem CID 20727735) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-cyclopentyl-N-methylprop-2-enamide.

Molecular Properties

Compound NameN-cyclopentyl-N-methylprop-2-enamide
PubChem CID20727735
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-cyclopentyl-N-methylprop-2-enamide
SMILESC=CC(=O)N(C)C1CCCC1
InChIInChI=1S/C9H15NO/c1-3-9(11)10(2)8-6-4-5-7-8/h3,8H,1,4-7H2,2H3
InChIKeyBISRKEFEBQIAEE-UHFFFAOYSA-N
XLogP1.57
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-methylprop-2-enamide?
The IUPAC name of N-cyclopentyl-N-methylprop-2-enamide (CID 20727735) is N-cyclopentyl-N-methylprop-2-enamide.
What is the SMILES notation for N-cyclopentyl-N-methylprop-2-enamide?
The canonical SMILES for N-cyclopentyl-N-methylprop-2-enamide is C=CC(=O)N(C)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-methylprop-2-enamide?
The InChIKey is BISRKEFEBQIAEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-3-9(11)10(2)8-6-4-5-7-8/h3,8H,1,4-7H2,2H3.
What are the key properties of N-cyclopentyl-N-methylprop-2-enamide?
N-cyclopentyl-N-methylprop-2-enamide has a molecular weight of 153.22 g/mol, XLogP of 1.57, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-methylprop-2-enamide is sourced from PubChem (CID 20727735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).