3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine

C16H18N2 — CID 114605965

IUPAC3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine
SMILESCc1ccnc(N)c1-c1ccccc1C1CCC1
InChIInChI=1S/C16H18N2/c1-11-9-10-18-16(17)15(11)14-8-3-2-7-13(14)12-5-4-6-12/h2-3,7-10,12H,4-6H2,1H3,(H2,17,18)
InChIKeyPAVIDLGDMFGDOO-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.91
Rot. Bonds2

About 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine

3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine (PubChem CID 114605965) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine.

Molecular Properties

Compound Name3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine
PubChem CID114605965
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine
SMILESCc1ccnc(N)c1-c1ccccc1C1CCC1
InChIInChI=1S/C16H18N2/c1-11-9-10-18-16(17)15(11)14-8-3-2-7-13(14)12-5-4-6-12/h2-3,7-10,12H,4-6H2,1H3,(H2,17,18)
InChIKeyPAVIDLGDMFGDOO-UHFFFAOYSA-N
XLogP3.91
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine?
The IUPAC name of 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine (CID 114605965) is 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine.
What is the SMILES notation for 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine?
The canonical SMILES for 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine is Cc1ccnc(N)c1-c1ccccc1C1CCC1.
What is the InChIKey of 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine?
The InChIKey is PAVIDLGDMFGDOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-11-9-10-18-16(17)15(11)14-8-3-2-7-13(14)12-5-4-6-12/h2-3,7-10,12H,4-6H2,1H3,(H2,17,18).
What are the key properties of 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine?
3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine has a molecular weight of 238.33 g/mol, XLogP of 3.91, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclobutylphenyl)-4-methylpyridin-2-amine is sourced from PubChem (CID 114605965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).