3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine

C15H23N — CID 64751059

IUPAC3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine
SMILESCc1cccc(C2(N)CC(C)CC(C)C2)c1
InChIInChI=1S/C15H23N/c1-11-5-4-6-14(8-11)15(16)9-12(2)7-13(3)10-15/h4-6,8,12-13H,7,9-10,16H2,1-3H3
InChIKeyNYWGXVUSPTVBMN-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.61
Rot. Bonds1

About 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine

3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine (PubChem CID 64751059) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine
PubChem CID64751059
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine
SMILESCc1cccc(C2(N)CC(C)CC(C)C2)c1
InChIInChI=1S/C15H23N/c1-11-5-4-6-14(8-11)15(16)9-12(2)7-13(3)10-15/h4-6,8,12-13H,7,9-10,16H2,1-3H3
InChIKeyNYWGXVUSPTVBMN-UHFFFAOYSA-N
XLogP3.61
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine (CID 64751059) is 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine is Cc1cccc(C2(N)CC(C)CC(C)C2)c1.
What is the InChIKey of 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine?
The InChIKey is NYWGXVUSPTVBMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-11-5-4-6-14(8-11)15(16)9-12(2)7-13(3)10-15/h4-6,8,12-13H,7,9-10,16H2,1-3H3.
What are the key properties of 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine?
3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-(3-methylphenyl)cyclohexan-1-amine is sourced from PubChem (CID 64751059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).