N-cyclohexyl-N-ethyl-2-methylpropanamide

C12H23NO — CID 669245

IUPACN-cyclohexyl-N-ethyl-2-methylpropanamide
SMILESCCN(C(=O)C(C)C)C1CCCCC1
InChIInChI=1S/C12H23NO/c1-4-13(12(14)10(2)3)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3
InChIKeySPRSQSIMDQBRDU-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.82
Rot. Bonds3

About N-cyclohexyl-N-ethyl-2-methylpropanamide

N-cyclohexyl-N-ethyl-2-methylpropanamide (PubChem CID 669245) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is N-cyclohexyl-N-ethyl-2-methylpropanamide.

Molecular Properties

Compound NameN-cyclohexyl-N-ethyl-2-methylpropanamide
PubChem CID669245
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC NameN-cyclohexyl-N-ethyl-2-methylpropanamide
SMILESCCN(C(=O)C(C)C)C1CCCCC1
InChIInChI=1S/C12H23NO/c1-4-13(12(14)10(2)3)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3
InChIKeySPRSQSIMDQBRDU-UHFFFAOYSA-N
XLogP2.82
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-ethyl-2-methylpropanamide?
The IUPAC name of N-cyclohexyl-N-ethyl-2-methylpropanamide (CID 669245) is N-cyclohexyl-N-ethyl-2-methylpropanamide.
What is the SMILES notation for N-cyclohexyl-N-ethyl-2-methylpropanamide?
The canonical SMILES for N-cyclohexyl-N-ethyl-2-methylpropanamide is CCN(C(=O)C(C)C)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-ethyl-2-methylpropanamide?
The InChIKey is SPRSQSIMDQBRDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-4-13(12(14)10(2)3)11-8-6-5-7-9-11/h10-11H,4-9H2,1-3H3.
What are the key properties of N-cyclohexyl-N-ethyl-2-methylpropanamide?
N-cyclohexyl-N-ethyl-2-methylpropanamide has a molecular weight of 197.32 g/mol, XLogP of 2.82, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-ethyl-2-methylpropanamide is sourced from PubChem (CID 669245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).