4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine

C15H15ClN2 — CID 132590588

IUPAC4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine
SMILESNc1c(-c2cccc(Cl)c2)ccnc1C1CCC1
InChIInChI=1S/C15H15ClN2/c16-12-6-2-5-11(9-12)13-7-8-18-15(14(13)17)10-3-1-4-10/h2,5-10H,1,3-4,17H2
InChIKeyCKOGJHCYPRCCHA-UHFFFAOYSA-N
MW258.75 g/mol
LogP4.25
Rot. Bonds2

About 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine

4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine (PubChem CID 132590588) has the molecular formula C15H15ClN2 and a molecular weight of 258.75 g/mol. Its IUPAC name is 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine.

Molecular Properties

Compound Name4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine
PubChem CID132590588
Molecular FormulaC15H15ClN2
Molecular Weight258.75 g/mol
Exact Mass258.09
IUPAC Name4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine
SMILESNc1c(-c2cccc(Cl)c2)ccnc1C1CCC1
InChIInChI=1S/C15H15ClN2/c16-12-6-2-5-11(9-12)13-7-8-18-15(14(13)17)10-3-1-4-10/h2,5-10H,1,3-4,17H2
InChIKeyCKOGJHCYPRCCHA-UHFFFAOYSA-N
XLogP4.25
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.75
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine?
The IUPAC name of 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine (CID 132590588) is 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine.
What is the SMILES notation for 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine?
The canonical SMILES for 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine is Nc1c(-c2cccc(Cl)c2)ccnc1C1CCC1.
What is the InChIKey of 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine?
The InChIKey is CKOGJHCYPRCCHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2/c16-12-6-2-5-11(9-12)13-7-8-18-15(14(13)17)10-3-1-4-10/h2,5-10H,1,3-4,17H2.
What are the key properties of 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine?
4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine has a molecular weight of 258.75 g/mol, XLogP of 4.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-chlorophenyl)-2-cyclobutylpyridin-3-amine is sourced from PubChem (CID 132590588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).