1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine

C14H22N2 — CID 63839255

IUPAC1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
SMILESCNC(c1cc(C)ccn1)C1CCCCC1
InChIInChI=1S/C14H22N2/c1-11-8-9-16-13(10-11)14(15-2)12-6-4-3-5-7-12/h8-10,12,14-15H,3-7H2,1-2H3
InChIKeyOBAFWRZANIAULN-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.23
Rot. Bonds3

About 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine

1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine (PubChem CID 63839255) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
PubChem CID63839255
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
SMILESCNC(c1cc(C)ccn1)C1CCCCC1
InChIInChI=1S/C14H22N2/c1-11-8-9-16-13(10-11)14(15-2)12-6-4-3-5-7-12/h8-10,12,14-15H,3-7H2,1-2H3
InChIKeyOBAFWRZANIAULN-UHFFFAOYSA-N
XLogP3.23
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
The IUPAC name of 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine (CID 63839255) is 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
The canonical SMILES for 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine is CNC(c1cc(C)ccn1)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
The InChIKey is OBAFWRZANIAULN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-8-9-16-13(10-11)14(15-2)12-6-4-3-5-7-12/h8-10,12,14-15H,3-7H2,1-2H3.
What are the key properties of 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine?
1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine has a molecular weight of 218.34 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 63839255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).