(4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine

C11H15ClN2 — CID 162341237

IUPAC(4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine
SMILESCc1cc(Cl)cc(C(N)C2CCC2)n1
InChIInChI=1S/C11H15ClN2/c1-7-5-9(12)6-10(14-7)11(13)8-3-2-4-8/h5-6,8,11H,2-4,13H2,1H3
InChIKeyXQGXXBQDAPSFDC-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.84
Rot. Bonds2

About (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine

(4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine (PubChem CID 162341237) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine.

Molecular Properties

Compound Name(4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine
PubChem CID162341237
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name(4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine
SMILESCc1cc(Cl)cc(C(N)C2CCC2)n1
InChIInChI=1S/C11H15ClN2/c1-7-5-9(12)6-10(14-7)11(13)8-3-2-4-8/h5-6,8,11H,2-4,13H2,1H3
InChIKeyXQGXXBQDAPSFDC-UHFFFAOYSA-N
XLogP2.84
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine?
The IUPAC name of (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine (CID 162341237) is (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine.
What is the SMILES notation for (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine?
The canonical SMILES for (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine is Cc1cc(Cl)cc(C(N)C2CCC2)n1.
What is the InChIKey of (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine?
The InChIKey is XQGXXBQDAPSFDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-7-5-9(12)6-10(14-7)11(13)8-3-2-4-8/h5-6,8,11H,2-4,13H2,1H3.
What are the key properties of (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine?
(4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine has a molecular weight of 210.71 g/mol, XLogP of 2.84, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-6-methyl-2-pyridinyl)-cyclobutylmethanamine is sourced from PubChem (CID 162341237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).