N-cyclohexyl-N-ethylformamide

C9H17NO — CID 10773210

IUPACN-cyclohexyl-N-ethylformamide
SMILESCCN(C=O)C1CCCCC1
InChIInChI=1S/C9H17NO/c1-2-10(8-11)9-6-4-3-5-7-9/h8-9H,2-7H2,1H3
InChIKeyBNTVUXYRPWLPFG-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.80
Rot. Bonds3

About N-cyclohexyl-N-ethylformamide

N-cyclohexyl-N-ethylformamide (PubChem CID 10773210) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-cyclohexyl-N-ethylformamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethylformamide
PubChem CID10773210
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-cyclohexyl-N-ethylformamide
SMILESCCN(C=O)C1CCCCC1
InChIInChI=1S/C9H17NO/c1-2-10(8-11)9-6-4-3-5-7-9/h8-9H,2-7H2,1H3
InChIKeyBNTVUXYRPWLPFG-UHFFFAOYSA-N
XLogP1.80
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.80
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-cyclohexyl-N-ethylformamide?
The IUPAC name of N-cyclohexyl-N-ethylformamide (CID 10773210) is N-cyclohexyl-N-ethylformamide.
What is the SMILES notation for N-cyclohexyl-N-ethylformamide?
The canonical SMILES for N-cyclohexyl-N-ethylformamide is CCN(C=O)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-ethylformamide?
The InChIKey is BNTVUXYRPWLPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-2-10(8-11)9-6-4-3-5-7-9/h8-9H,2-7H2,1H3.
What are the key properties of N-cyclohexyl-N-ethylformamide?
N-cyclohexyl-N-ethylformamide has a molecular weight of 155.24 g/mol, XLogP of 1.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethylformamide is sourced from PubChem (CID 10773210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).