(2-chlorophenyl)-(4-propylcyclohexyl)methanamine

C16H24ClN — CID 65422989

IUPAC(2-chlorophenyl)-(4-propylcyclohexyl)methanamine
SMILESCCCC1CCC(C(N)c2ccccc2Cl)CC1
InChIInChI=1S/C16H24ClN/c1-2-5-12-8-10-13(11-9-12)16(18)14-6-3-4-7-15(14)17/h3-4,6-7,12-13,16H,2,5,8-11,18H2,1H3
InChIKeyWQCWCRNKVMSSPN-UHFFFAOYSA-N
MW265.83 g/mol
LogP4.95
Rot. Bonds4

About (2-chlorophenyl)-(4-propylcyclohexyl)methanamine

(2-chlorophenyl)-(4-propylcyclohexyl)methanamine (PubChem CID 65422989) has the molecular formula C16H24ClN and a molecular weight of 265.83 g/mol. Its IUPAC name is (2-chlorophenyl)-(4-propylcyclohexyl)methanamine.

Molecular Properties

Compound Name(2-chlorophenyl)-(4-propylcyclohexyl)methanamine
PubChem CID65422989
Molecular FormulaC16H24ClN
Molecular Weight265.83 g/mol
Exact Mass265.16
IUPAC Name(2-chlorophenyl)-(4-propylcyclohexyl)methanamine
SMILESCCCC1CCC(C(N)c2ccccc2Cl)CC1
InChIInChI=1S/C16H24ClN/c1-2-5-12-8-10-13(11-9-12)16(18)14-6-3-4-7-15(14)17/h3-4,6-7,12-13,16H,2,5,8-11,18H2,1H3
InChIKeyWQCWCRNKVMSSPN-UHFFFAOYSA-N
XLogP4.95
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.83
LogP ≤ 54.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2,5-dichlorophenyl)-(4-propylcyclohexyl)methanamine
CID 65423953
N-[(2-chlorophenyl)-(4-propylcyclohexyl)methyl]propan-1-amine
CID 65425524
(R)-(2-chlorophenyl)-cyclopentylmethanamine
CID 91256846
(2,3-dichlorophenyl)-(4-ethylcyclohexyl)methanamine
CID 65393105
N-[(1R)-1-(2-chlorophenyl)ethyl]-4-propylcyclohexan-1-amine
CID 29040454
(4-butylcyclohexyl)-(2-fluorophenyl)methanamine
CID 115827979
N-[1-(2-chlorophenyl)ethyl]-4-propylcyclohexan-1-amine
CID 43079434
[(2,3-dichlorophenyl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232276
cyclopropyl-(2,3-dichlorophenyl)methanamine
CID 62789310
(4-ethoxyphenyl)-(4-propylcyclohexyl)methanamine
CID 65422984
(4-butylcyclohexyl)-(2,3-difluorophenyl)methanamine
CID 115861911
(5-chloro-1-benzofuran-2-yl)-(4-propylcyclohexyl)methanamine
CID 114729243

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)-(4-propylcyclohexyl)methanamine?
The IUPAC name of (2-chlorophenyl)-(4-propylcyclohexyl)methanamine (CID 65422989) is (2-chlorophenyl)-(4-propylcyclohexyl)methanamine.
What is the SMILES notation for (2-chlorophenyl)-(4-propylcyclohexyl)methanamine?
The canonical SMILES for (2-chlorophenyl)-(4-propylcyclohexyl)methanamine is CCCC1CCC(C(N)c2ccccc2Cl)CC1.
What is the InChIKey of (2-chlorophenyl)-(4-propylcyclohexyl)methanamine?
The InChIKey is WQCWCRNKVMSSPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN/c1-2-5-12-8-10-13(11-9-12)16(18)14-6-3-4-7-15(14)17/h3-4,6-7,12-13,16H,2,5,8-11,18H2,1H3.
What are the key properties of (2-chlorophenyl)-(4-propylcyclohexyl)methanamine?
(2-chlorophenyl)-(4-propylcyclohexyl)methanamine has a molecular weight of 265.83 g/mol, XLogP of 4.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)-(4-propylcyclohexyl)methanamine is sourced from PubChem (CID 65422989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).