N-ethylcyclohexene-1-carboxamide

C9H15NO — CID 18712338

IUPACN-ethylcyclohexene-1-carboxamide
SMILESCCNC(=O)C1=CCCCC1
InChIInChI=1S/C9H15NO/c1-2-10-9(11)8-6-4-3-5-7-8/h6H,2-5,7H2,1H3,(H,10,11)
InChIKeyVRZOVIZDKITXJT-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.62
Rot. Bonds2

About N-ethylcyclohexene-1-carboxamide

N-ethylcyclohexene-1-carboxamide (PubChem CID 18712338) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is N-ethylcyclohexene-1-carboxamide.

Molecular Properties

Compound NameN-ethylcyclohexene-1-carboxamide
PubChem CID18712338
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC NameN-ethylcyclohexene-1-carboxamide
SMILESCCNC(=O)C1=CCCCC1
InChIInChI=1S/C9H15NO/c1-2-10-9(11)8-6-4-3-5-7-8/h6H,2-5,7H2,1H3,(H,10,11)
InChIKeyVRZOVIZDKITXJT-UHFFFAOYSA-N
XLogP1.62
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethylcyclohexene-1-carboxamide?
The IUPAC name of N-ethylcyclohexene-1-carboxamide (CID 18712338) is N-ethylcyclohexene-1-carboxamide.
What is the SMILES notation for N-ethylcyclohexene-1-carboxamide?
The canonical SMILES for N-ethylcyclohexene-1-carboxamide is CCNC(=O)C1=CCCCC1.
What is the InChIKey of N-ethylcyclohexene-1-carboxamide?
The InChIKey is VRZOVIZDKITXJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-2-10-9(11)8-6-4-3-5-7-8/h6H,2-5,7H2,1H3,(H,10,11).
What are the key properties of N-ethylcyclohexene-1-carboxamide?
N-ethylcyclohexene-1-carboxamide has a molecular weight of 153.22 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethylcyclohexene-1-carboxamide is sourced from PubChem (CID 18712338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).