1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine

C17H27NO — CID 65445325

IUPAC1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine
SMILESCNC(CCc1ccc(OC)cc1)C1CCCCC1
InChIInChI=1S/C17H27NO/c1-18-17(15-6-4-3-5-7-15)13-10-14-8-11-16(19-2)12-9-14/h8-9,11-12,15,17-18H,3-7,10,13H2,1-2H3
InChIKeySEZMKRSNKWEFMQ-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.80
Rot. Bonds6

About 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine

1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine (PubChem CID 65445325) has the molecular formula C17H27NO and a molecular weight of 261.41 g/mol. Its IUPAC name is 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine
PubChem CID65445325
Molecular FormulaC17H27NO
Molecular Weight261.41 g/mol
Exact Mass261.21
IUPAC Name1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine
SMILESCNC(CCc1ccc(OC)cc1)C1CCCCC1
InChIInChI=1S/C17H27NO/c1-18-17(15-6-4-3-5-7-15)13-10-14-8-11-16(19-2)12-9-14/h8-9,11-12,15,17-18H,3-7,10,13H2,1-2H3
InChIKeySEZMKRSNKWEFMQ-UHFFFAOYSA-N
XLogP3.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-2-(4-methoxyphenyl)-N-methylethanamine
CID 54980091
1-cyclobutyl-3-(4-methoxyphenyl)-N-propylpropan-1-amine
CID 65446483
1-cyclooctyl-3-(4-methoxyphenyl)propan-1-ol
CID 80603730
3-(4-methoxyphenyl)-N-methyl-1-(thiolan-2-yl)propan-1-amine
CID 80621656
N-[4-(4-methoxyphenyl)butan-2-yl]cyclohexanamine
CID 43755987
1-cyclobutyl-3-(4-methoxyphenyl)propan-1-amine
CID 65446100
N-ethyl-3-(4-methoxyphenyl)-1-(4-methylcyclohexyl)propan-1-amine
CID 65445898
N-[2-(4-methoxyphenyl)ethyl]cyclohexanamine;hydrochloride
CID 23106150
N-(cyclopentylmethyl)-4-(4-methoxyphenyl)butan-2-amine
CID 43775517
1-cyclohexyl-N-[1-(4-methoxyphenyl)propan-2-yl]propan-1-amine
CID 63476458
1-cyclohexyl-2-(3-methoxyphenyl)-N-methylethanamine
CID 61066272
1-cycloheptyl-N-methyl-3-pyridin-3-ylpropan-1-amine
CID 105176320

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The IUPAC name of 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine (CID 65445325) is 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The canonical SMILES for 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine is CNC(CCc1ccc(OC)cc1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
The InChIKey is SEZMKRSNKWEFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO/c1-18-17(15-6-4-3-5-7-15)13-10-14-8-11-16(19-2)12-9-14/h8-9,11-12,15,17-18H,3-7,10,13H2,1-2H3.
What are the key properties of 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine?
1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine has a molecular weight of 261.41 g/mol, XLogP of 3.80, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(4-methoxyphenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 65445325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).