5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine

C12H15N — CID 94035148

IUPAC5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine
SMILESCc1ccc([C@H]2C=CCCC2)cn1
InChIInChI=1S/C12H15N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h3,5,7-9,11H,2,4,6H2,1H3/t11-/m0/s1
InChIKeyWAZNOSRDMRPCON-NSHDSACASA-N
MW173.26 g/mol
LogP3.21
Rot. Bonds1

About 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine

5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine (PubChem CID 94035148) has the molecular formula C12H15N and a molecular weight of 173.26 g/mol. Its IUPAC name is 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine.

Molecular Properties

Compound Name5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine
PubChem CID94035148
Molecular FormulaC12H15N
Molecular Weight173.26 g/mol
Exact Mass173.12
IUPAC Name5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine
SMILESCc1ccc([C@H]2C=CCCC2)cn1
InChIInChI=1S/C12H15N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h3,5,7-9,11H,2,4,6H2,1H3/t11-/m0/s1
InChIKeyWAZNOSRDMRPCON-NSHDSACASA-N
XLogP3.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-chloro-5-[(1R)-cyclohex-2-en-1-yl]pyridine
CID 94035152
4-cyclohex-2-en-1-ylaniline
CID 3026820
4-cyclohex-2-en-1-ylpyridine
CID 12718499
4-cyclohex-2-en-1-ylphenol
CID 13414842
1-[(1R)-cyclohex-2-en-1-yl]-4-methoxybenzene
CID 11435403
5-(aziridin-2-yl)-2-methylpyridine
CID 129016898
3-(6-methyl-3-pyridinyl)cyclohexan-1-amine
CID 64503423
2-methyl-5-pyrrolidin-2-ylpyridine;dihydrochloride
CID 170920850
N-[[2-(6-methyl-3-pyridinyl)cyclopentyl]methyl]cyclopropanamine
CID 81034690
2-(6-methyl-3-pyridinyl)cycloheptan-1-amine
CID 63156067
5-(2-chlorocycloheptyl)-2-methylpyridine
CID 63156025
2-methyl-5-(1-methylpyrrolidin-2-yl)pyridine
CID 5020711

Frequently Asked Questions

What is the IUPAC name of 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine?
The IUPAC name of 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine (CID 94035148) is 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine.
What is the SMILES notation for 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine?
The canonical SMILES for 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine is Cc1ccc([C@H]2C=CCCC2)cn1.
What is the InChIKey of 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine?
The InChIKey is WAZNOSRDMRPCON-NSHDSACASA-N. The full InChI is InChI=1S/C12H15N/c1-10-7-8-12(9-13-10)11-5-3-2-4-6-11/h3,5,7-9,11H,2,4,6H2,1H3/t11-/m0/s1.
What are the key properties of 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine?
5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine has a molecular weight of 173.26 g/mol, XLogP of 3.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(1R)-cyclohex-2-en-1-yl]-2-methylpyridine is sourced from PubChem (CID 94035148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).