1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine

C15H24N2 — CID 66446718

IUPAC1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine
SMILESCc1ccc(CC(N)CC2CCCCC2)nc1
InChIInChI=1S/C15H24N2/c1-12-7-8-15(17-11-12)10-14(16)9-13-5-3-2-4-6-13/h7-8,11,13-14H,2-6,9-10,16H2,1H3
InChIKeyFMHIFXXDBPAURZ-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.23
Rot. Bonds4

About 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine

1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine (PubChem CID 66446718) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine.

Molecular Properties

Compound Name1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine
PubChem CID66446718
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine
SMILESCc1ccc(CC(N)CC2CCCCC2)nc1
InChIInChI=1S/C15H24N2/c1-12-7-8-15(17-11-12)10-14(16)9-13-5-3-2-4-6-13/h7-8,11,13-14H,2-6,9-10,16H2,1H3
InChIKeyFMHIFXXDBPAURZ-UHFFFAOYSA-N
XLogP3.23
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
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-3-(5-methyl-2-pyridinyl)propan-2-amine?
The IUPAC name of 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine (CID 66446718) is 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine.
What is the SMILES notation for 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine?
The canonical SMILES for 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine is Cc1ccc(CC(N)CC2CCCCC2)nc1.
What is the InChIKey of 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine?
The InChIKey is FMHIFXXDBPAURZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-12-7-8-15(17-11-12)10-14(16)9-13-5-3-2-4-6-13/h7-8,11,13-14H,2-6,9-10,16H2,1H3.
What are the key properties of 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine?
1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine has a molecular weight of 232.37 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-3-(5-methyl-2-pyridinyl)propan-2-amine is sourced from PubChem (CID 66446718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).