3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine

C15H23N — CID 59352030

IUPAC3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine
SMILESCc1cnccc1C1CCC(C(C)C)CC1
InChIInChI=1S/C15H23N/c1-11(2)13-4-6-14(7-5-13)15-8-9-16-10-12(15)3/h8-11,13-14H,4-7H2,1-3H3
InChIKeyYMPXENQDHBFZQT-UHFFFAOYSA-N
MW217.36 g/mol
LogP4.32
Rot. Bonds2

About 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine

3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine (PubChem CID 59352030) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine.

Molecular Properties

Compound Name3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine
PubChem CID59352030
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine
SMILESCc1cnccc1C1CCC(C(C)C)CC1
InChIInChI=1S/C15H23N/c1-11(2)13-4-6-14(7-5-13)15-8-9-16-10-12(15)3/h8-11,13-14H,4-7H2,1-3H3
InChIKeyYMPXENQDHBFZQT-UHFFFAOYSA-N
XLogP4.32
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine?
The IUPAC name of 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine (CID 59352030) is 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine.
What is the SMILES notation for 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine?
The canonical SMILES for 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine is Cc1cnccc1C1CCC(C(C)C)CC1.
What is the InChIKey of 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine?
The InChIKey is YMPXENQDHBFZQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-11(2)13-4-6-14(7-5-13)15-8-9-16-10-12(15)3/h8-11,13-14H,4-7H2,1-3H3.
What are the key properties of 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine?
3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine has a molecular weight of 217.36 g/mol, XLogP of 4.32, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-(4-propan-2-ylcyclohexyl)pyridine is sourced from PubChem (CID 59352030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).