N-benzyl-2-ethylcyclohexan-1-amine

C15H23N — CID 43434056

IUPACN-benzyl-2-ethylcyclohexan-1-amine
SMILESCCC1CCCCC1NCc1ccccc1
InChIInChI=1S/C15H23N/c1-2-14-10-6-7-11-15(14)16-12-13-8-4-3-5-9-13/h3-5,8-9,14-16H,2,6-7,10-12H2,1H3
InChIKeyTWWVFAKDWNLWLX-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.74
Rot. Bonds4

About N-benzyl-2-ethylcyclohexan-1-amine

N-benzyl-2-ethylcyclohexan-1-amine (PubChem CID 43434056) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is N-benzyl-2-ethylcyclohexan-1-amine.

Molecular Properties

Compound NameN-benzyl-2-ethylcyclohexan-1-amine
PubChem CID43434056
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC NameN-benzyl-2-ethylcyclohexan-1-amine
SMILESCCC1CCCCC1NCc1ccccc1
InChIInChI=1S/C15H23N/c1-2-14-10-6-7-11-15(14)16-12-13-8-4-3-5-9-13/h3-5,8-9,14-16H,2,6-7,10-12H2,1H3
InChIKeyTWWVFAKDWNLWLX-UHFFFAOYSA-N
XLogP3.74
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-ethylcyclohexan-1-amine?
The IUPAC name of N-benzyl-2-ethylcyclohexan-1-amine (CID 43434056) is N-benzyl-2-ethylcyclohexan-1-amine.
What is the SMILES notation for N-benzyl-2-ethylcyclohexan-1-amine?
The canonical SMILES for N-benzyl-2-ethylcyclohexan-1-amine is CCC1CCCCC1NCc1ccccc1.
What is the InChIKey of N-benzyl-2-ethylcyclohexan-1-amine?
The InChIKey is TWWVFAKDWNLWLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-2-14-10-6-7-11-15(14)16-12-13-8-4-3-5-9-13/h3-5,8-9,14-16H,2,6-7,10-12H2,1H3.
What are the key properties of N-benzyl-2-ethylcyclohexan-1-amine?
N-benzyl-2-ethylcyclohexan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-ethylcyclohexan-1-amine is sourced from PubChem (CID 43434056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).