2-naphthalen-1-yl-4-propylcyclohexan-1-amine

C19H25N — CID 81014619

IUPAC2-naphthalen-1-yl-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N)C(c2cccc3ccccc23)C1
InChIInChI=1S/C19H25N/c1-2-6-14-11-12-19(20)18(13-14)17-10-5-8-15-7-3-4-9-16(15)17/h3-5,7-10,14,18-19H,2,6,11-13,20H2,1H3
InChIKeyQFFHUURSYNUJKK-UHFFFAOYSA-N
MW267.42 g/mol
LogP4.85
Rot. Bonds3

About 2-naphthalen-1-yl-4-propylcyclohexan-1-amine

2-naphthalen-1-yl-4-propylcyclohexan-1-amine (PubChem CID 81014619) has the molecular formula C19H25N and a molecular weight of 267.42 g/mol. Its IUPAC name is 2-naphthalen-1-yl-4-propylcyclohexan-1-amine.

Molecular Properties

Compound Name2-naphthalen-1-yl-4-propylcyclohexan-1-amine
PubChem CID81014619
Molecular FormulaC19H25N
Molecular Weight267.42 g/mol
Exact Mass267.20
IUPAC Name2-naphthalen-1-yl-4-propylcyclohexan-1-amine
SMILESCCCC1CCC(N)C(c2cccc3ccccc23)C1
InChIInChI=1S/C19H25N/c1-2-6-14-11-12-19(20)18(13-14)17-10-5-8-15-7-3-4-9-16(15)17/h3-5,7-10,14,18-19H,2,6,11-13,20H2,1H3
InChIKeyQFFHUURSYNUJKK-UHFFFAOYSA-N
XLogP4.85
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-1-yl-4-propylcyclohexan-1-amine?
The IUPAC name of 2-naphthalen-1-yl-4-propylcyclohexan-1-amine (CID 81014619) is 2-naphthalen-1-yl-4-propylcyclohexan-1-amine.
What is the SMILES notation for 2-naphthalen-1-yl-4-propylcyclohexan-1-amine?
The canonical SMILES for 2-naphthalen-1-yl-4-propylcyclohexan-1-amine is CCCC1CCC(N)C(c2cccc3ccccc23)C1.
What is the InChIKey of 2-naphthalen-1-yl-4-propylcyclohexan-1-amine?
The InChIKey is QFFHUURSYNUJKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N/c1-2-6-14-11-12-19(20)18(13-14)17-10-5-8-15-7-3-4-9-16(15)17/h3-5,7-10,14,18-19H,2,6,11-13,20H2,1H3.
What are the key properties of 2-naphthalen-1-yl-4-propylcyclohexan-1-amine?
2-naphthalen-1-yl-4-propylcyclohexan-1-amine has a molecular weight of 267.42 g/mol, XLogP of 4.85, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-1-yl-4-propylcyclohexan-1-amine is sourced from PubChem (CID 81014619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).