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

C14H22N2 — CID 115373859

IUPAC3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1cncc(C2(N)CCCC(C)(C)C2)c1
InChIInChI=1S/C14H22N2/c1-11-7-12(9-16-8-11)14(15)6-4-5-13(2,3)10-14/h7-9H,4-6,10,15H2,1-3H3
InChIKeyBGTOBABRWFPILZ-UHFFFAOYSA-N
MW218.34 g/mol
LogP3.14
Rot. Bonds1

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

3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine (PubChem CID 115373859) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine
PubChem CID115373859
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine
SMILESCc1cncc(C2(N)CCCC(C)(C)C2)c1
InChIInChI=1S/C14H22N2/c1-11-7-12(9-16-8-11)14(15)6-4-5-13(2,3)10-14/h7-9H,4-6,10,15H2,1-3H3
InChIKeyBGTOBABRWFPILZ-UHFFFAOYSA-N
XLogP3.14
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 ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(5-methyl-3-pyridinyl)oxan-3-amine
CID 115373854
2,2-dimethyl-1-(5-methyl-3-pyridinyl)cyclopentan-1-amine
CID 115373875
4-tert-butyl-1-(5-methyl-3-pyridinyl)cycloheptan-1-amine
CID 115373871
4-ethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine
CID 115373824
1-(3-fluoro-5-methylphenyl)-3,3-dimethylcyclopentan-1-amine
CID 80693292
1-(5-methoxy-3-pyridinyl)-3,3,5,5-tetramethylcyclohexan-1-amine
CID 112682795
1-(5-bromo-3-pyridinyl)cyclopentan-1-amine
CID 131597896
3-methyl-3-(5-methyl-3-pyridinyl)cyclopentan-1-one
CID 116538519
1-(5-methylpyrimidin-2-yl)cyclobutan-1-amine
CID 130545603
(1-aminocyclopentyl)-(5-methyl-3-pyridinyl)methanone
CID 116558812
(1-methylcyclopentyl)-(5-methyl-3-pyridinyl)methanamine
CID 105022796
[5-(1-aminocyclopropyl)-3-pyridinyl]boronic acid
CID 55296556

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine?
The IUPAC name of 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine (CID 115373859) is 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine.
What is the SMILES notation for 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine?
The canonical SMILES for 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine is Cc1cncc(C2(N)CCCC(C)(C)C2)c1.
What is the InChIKey of 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine?
The InChIKey is BGTOBABRWFPILZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-11-7-12(9-16-8-11)14(15)6-4-5-13(2,3)10-14/h7-9H,4-6,10,15H2,1-3H3.
What are the key properties of 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine?
3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine has a molecular weight of 218.34 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(5-methyl-3-pyridinyl)cyclohexan-1-amine is sourced from PubChem (CID 115373859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).