1-cyclohexyl-N-methyl-6-phenylhexan-3-amine

C19H31N — CID 115849338

IUPAC1-cyclohexyl-N-methyl-6-phenylhexan-3-amine
SMILESCNC(CCCc1ccccc1)CCC1CCCCC1
InChIInChI=1S/C19H31N/c1-20-19(16-15-18-11-6-3-7-12-18)14-8-13-17-9-4-2-5-10-17/h2,4-5,9-10,18-20H,3,6-8,11-16H2,1H3
InChIKeyNYQYNIGICXBHLP-UHFFFAOYSA-N
MW273.46 g/mol
LogP4.96
Rot. Bonds8

About 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine

1-cyclohexyl-N-methyl-6-phenylhexan-3-amine (PubChem CID 115849338) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine.

Molecular Properties

Compound Name1-cyclohexyl-N-methyl-6-phenylhexan-3-amine
PubChem CID115849338
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC Name1-cyclohexyl-N-methyl-6-phenylhexan-3-amine
SMILESCNC(CCCc1ccccc1)CCC1CCCCC1
InChIInChI=1S/C19H31N/c1-20-19(16-15-18-11-6-3-7-12-18)14-8-13-17-9-4-2-5-10-17/h2,4-5,9-10,18-20H,3,6-8,11-16H2,1H3
InChIKeyNYQYNIGICXBHLP-UHFFFAOYSA-N
XLogP4.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.46
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1-cyclohexyl-5-phenylpentan-3-yl)hydrazine
CID 105285878
1-methoxy-N-methyl-6-phenylhexan-3-amine
CID 62605190
1-cyclohexyl-5-(furan-2-yl)-N-methylpentan-3-amine
CID 114193094
1-cyclopentyl-N-methyl-5-pyridin-2-ylpentan-3-amine
CID 114193168
2-phenylethylcyclooctane
CID 54073487
(5-cyclohexyl-3-methoxypentyl)benzene
CID 143381268
1-(3-chlorophenyl)-4-cyclohexyl-N-methylbutan-2-amine
CID 63528999
1-cycloheptyl-N-methyl-3-phenylpropan-2-amine
CID 114458143
1-cyclohexyl-5-phenylpentan-3-amine
CID 115793645
4-cyclopentyl-N-ethyl-1-phenylbutan-2-amine
CID 63526556
1-cyclopropyl-N-methyl-6-thiophen-2-ylhexan-3-amine
CID 105157838
N-methyl-1,5-diphenylpentan-3-amine
CID 10586995

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine?
The IUPAC name of 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine (CID 115849338) is 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine.
What is the SMILES notation for 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine?
The canonical SMILES for 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine is CNC(CCCc1ccccc1)CCC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine?
The InChIKey is NYQYNIGICXBHLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-20-19(16-15-18-11-6-3-7-12-18)14-8-13-17-9-4-2-5-10-17/h2,4-5,9-10,18-20H,3,6-8,11-16H2,1H3.
What are the key properties of 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine?
1-cyclohexyl-N-methyl-6-phenylhexan-3-amine has a molecular weight of 273.46 g/mol, XLogP of 4.96, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methyl-6-phenylhexan-3-amine is sourced from PubChem (CID 115849338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).