(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine

C14H22N2 — CID 64775459

IUPAC(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine
SMILESCc1ccnc(C(N)C2CCC(C)CC2)c1
InChIInChI=1S/C14H22N2/c1-10-3-5-12(6-4-10)14(15)13-9-11(2)7-8-16-13/h7-10,12,14H,3-6,15H2,1-2H3
InChIKeyCDYHFFXJBRGHIR-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.22
Rot. Bonds2

About (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine

(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine (PubChem CID 64775459) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine
PubChem CID64775459
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine
SMILESCc1ccnc(C(N)C2CCC(C)CC2)c1
InChIInChI=1S/C14H22N2/c1-10-3-5-12(6-4-10)14(15)13-9-11(2)7-8-16-13/h7-10,12,14H,3-6,15H2,1-2H3
InChIKeyCDYHFFXJBRGHIR-UHFFFAOYSA-N
XLogP3.22
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine?
The IUPAC name of (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine (CID 64775459) is (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine?
The canonical SMILES for (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine is Cc1ccnc(C(N)C2CCC(C)CC2)c1.
What is the InChIKey of (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine?
The InChIKey is CDYHFFXJBRGHIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-10-3-5-12(6-4-10)14(15)13-9-11(2)7-8-16-13/h7-10,12,14H,3-6,15H2,1-2H3.
What are the key properties of (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine?
(4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine has a molecular weight of 218.34 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylcyclohexyl)-(4-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 64775459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).