N-(cyclohexen-1-yl)-N-ethylformamide

C9H15NO — CID 173130830

IUPACN-(cyclohexen-1-yl)-N-ethylformamide
SMILESCCN(C=O)C1=CCCCC1
InChIInChI=1S/C9H15NO/c1-2-10(8-11)9-6-4-3-5-7-9/h6,8H,2-5,7H2,1H3
InChIKeyLAMXUGWFBWOPIH-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.92
Rot. Bonds3

About N-(cyclohexen-1-yl)-N-ethylformamide

N-(cyclohexen-1-yl)-N-ethylformamide (PubChem CID 173130830) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-(cyclohexen-1-yl)-N-ethylformamide.

Molecular Properties

Compound NameN-(cyclohexen-1-yl)-N-ethylformamide
PubChem CID173130830
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-(cyclohexen-1-yl)-N-ethylformamide
SMILESCCN(C=O)C1=CCCCC1
InChIInChI=1S/C9H15NO/c1-2-10(8-11)9-6-4-3-5-7-9/h6,8H,2-5,7H2,1H3
InChIKeyLAMXUGWFBWOPIH-UHFFFAOYSA-N
XLogP1.92
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(cyclohexen-1-yl)-N-ethylformamide?
The IUPAC name of N-(cyclohexen-1-yl)-N-ethylformamide (CID 173130830) is N-(cyclohexen-1-yl)-N-ethylformamide.
What is the SMILES notation for N-(cyclohexen-1-yl)-N-ethylformamide?
The canonical SMILES for N-(cyclohexen-1-yl)-N-ethylformamide is CCN(C=O)C1=CCCCC1.
What is the InChIKey of N-(cyclohexen-1-yl)-N-ethylformamide?
The InChIKey is LAMXUGWFBWOPIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-10(8-11)9-6-4-3-5-7-9/h6,8H,2-5,7H2,1H3.
What are the key properties of N-(cyclohexen-1-yl)-N-ethylformamide?
N-(cyclohexen-1-yl)-N-ethylformamide has a molecular weight of 153.22 g/mol, XLogP of 1.92, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclohexen-1-yl)-N-ethylformamide is sourced from PubChem (CID 173130830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).