1-(2-methyl-3-pyridinyl)cyclohexan-1-amine

C12H18N2 — CID 96855234

IUPAC1-(2-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1ncccc1C1(N)CCCCC1
InChIInChI=1S/C12H18N2/c1-10-11(6-5-9-14-10)12(13)7-3-2-4-8-12/h5-6,9H,2-4,7-8,13H2,1H3
InChIKeyBBRPAOQCONKNGH-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.51
Rot. Bonds1

About 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine

1-(2-methyl-3-pyridinyl)cyclohexan-1-amine (PubChem CID 96855234) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine.

Molecular Properties

Compound Name1-(2-methyl-3-pyridinyl)cyclohexan-1-amine
PubChem CID96855234
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name1-(2-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1ncccc1C1(N)CCCCC1
InChIInChI=1S/C12H18N2/c1-10-11(6-5-9-14-10)12(13)7-3-2-4-8-12/h5-6,9H,2-4,7-8,13H2,1H3
InChIKeyBBRPAOQCONKNGH-UHFFFAOYSA-N
XLogP2.51
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine?
The IUPAC name of 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine (CID 96855234) is 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine.
What is the SMILES notation for 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine?
The canonical SMILES for 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine is Cc1ncccc1C1(N)CCCCC1.
What is the InChIKey of 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine?
The InChIKey is BBRPAOQCONKNGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-10-11(6-5-9-14-10)12(13)7-3-2-4-8-12/h5-6,9H,2-4,7-8,13H2,1H3.
What are the key properties of 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine?
1-(2-methyl-3-pyridinyl)cyclohexan-1-amine has a molecular weight of 190.29 g/mol, XLogP of 2.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-3-pyridinyl)cyclohexan-1-amine is sourced from PubChem (CID 96855234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).