2-(ethylamino)-2-phenylcyclohexan-1-one

C14H19NO — CID 132989542

IUPAC2-(ethylamino)-2-phenylcyclohexan-1-one
SMILESCCNC1(c2ccccc2)CCCCC1=O
InChIInChI=1S/C14H19NO/c1-2-15-14(11-7-6-10-13(14)16)12-8-4-3-5-9-12/h3-5,8-9,15H,2,6-7,10-11H2,1H3
InChIKeyIDLSBAANXISGEI-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.63
Rot. Bonds3

About 2-(ethylamino)-2-phenylcyclohexan-1-one

2-(ethylamino)-2-phenylcyclohexan-1-one (PubChem CID 132989542) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 2-(ethylamino)-2-phenylcyclohexan-1-one.

Molecular Properties

Compound Name2-(ethylamino)-2-phenylcyclohexan-1-one
PubChem CID132989542
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name2-(ethylamino)-2-phenylcyclohexan-1-one
SMILESCCNC1(c2ccccc2)CCCCC1=O
InChIInChI=1S/C14H19NO/c1-2-15-14(11-7-6-10-13(14)16)12-8-4-3-5-9-12/h3-5,8-9,15H,2,6-7,10-11H2,1H3
InChIKeyIDLSBAANXISGEI-UHFFFAOYSA-N
XLogP2.63
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-phenylcyclohexan-1-one?
The IUPAC name of 2-(ethylamino)-2-phenylcyclohexan-1-one (CID 132989542) is 2-(ethylamino)-2-phenylcyclohexan-1-one.
What is the SMILES notation for 2-(ethylamino)-2-phenylcyclohexan-1-one?
The canonical SMILES for 2-(ethylamino)-2-phenylcyclohexan-1-one is CCNC1(c2ccccc2)CCCCC1=O.
What is the InChIKey of 2-(ethylamino)-2-phenylcyclohexan-1-one?
The InChIKey is IDLSBAANXISGEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-15-14(11-7-6-10-13(14)16)12-8-4-3-5-9-12/h3-5,8-9,15H,2,6-7,10-11H2,1H3.
What are the key properties of 2-(ethylamino)-2-phenylcyclohexan-1-one?
2-(ethylamino)-2-phenylcyclohexan-1-one has a molecular weight of 217.31 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-phenylcyclohexan-1-one is sourced from PubChem (CID 132989542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).