3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine

C14H22N2 — CID 66272032

IUPAC3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1ccncc1C1(N)CC(C)CC(C)C1
InChIInChI=1S/C14H22N2/c1-10-6-11(2)8-14(15,7-10)13-9-16-5-4-12(13)3/h4-5,9-11H,6-8,15H2,1-3H3
InChIKeyAPFZBYJRTUVECP-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.00
Rot. Bonds1

About 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine

3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine (PubChem CID 66272032) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine
PubChem CID66272032
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1ccncc1C1(N)CC(C)CC(C)C1
InChIInChI=1S/C14H22N2/c1-10-6-11(2)8-14(15,7-10)13-9-16-5-4-12(13)3/h4-5,9-11H,6-8,15H2,1-3H3
InChIKeyAPFZBYJRTUVECP-UHFFFAOYSA-N
XLogP3.00
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine?
The IUPAC name of 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine (CID 66272032) is 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine.
What is the SMILES notation for 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine?
The canonical SMILES for 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine is Cc1ccncc1C1(N)CC(C)CC(C)C1.
What is the InChIKey of 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine?
The InChIKey is APFZBYJRTUVECP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-10-6-11(2)8-14(15,7-10)13-9-16-5-4-12(13)3/h4-5,9-11H,6-8,15H2,1-3H3.
What are the key properties of 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine?
3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine has a molecular weight of 218.34 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-1-(4-methyl-3-pyridinyl)cyclohexan-1-amine is sourced from PubChem (CID 66272032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).