6-chloro-N-(2-methylpropyl)pyridin-2-amine

C9H13ClN2 — CID 53410300

IUPAC6-chloro-N-(2-methylpropyl)pyridin-2-amine
SMILESCC(C)CNc1cccc(Cl)n1
InChIInChI=1S/C9H13ClN2/c1-7(2)6-11-9-5-3-4-8(10)12-9/h3-5,7H,6H2,1-2H3,(H,11,12)
InChIKeyRXXNKHYQCFKFBU-UHFFFAOYSA-N
MW184.67 g/mol
LogP2.80
Rot. Bonds3

About 6-chloro-N-(2-methylpropyl)pyridin-2-amine

6-chloro-N-(2-methylpropyl)pyridin-2-amine (PubChem CID 53410300) has the molecular formula C9H13ClN2 and a molecular weight of 184.67 g/mol. Its IUPAC name is 6-chloro-N-(2-methylpropyl)pyridin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(2-methylpropyl)pyridin-2-amine
PubChem CID53410300
Molecular FormulaC9H13ClN2
Molecular Weight184.67 g/mol
Exact Mass184.08
IUPAC Name6-chloro-N-(2-methylpropyl)pyridin-2-amine
SMILESCC(C)CNc1cccc(Cl)n1
InChIInChI=1S/C9H13ClN2/c1-7(2)6-11-9-5-3-4-8(10)12-9/h3-5,7H,6H2,1-2H3,(H,11,12)
InChIKeyRXXNKHYQCFKFBU-UHFFFAOYSA-N
XLogP2.80
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.67
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-chloro-N-(7-methyloctyl)pyridin-2-amine
CID 107817529
N-(2-methylpropyl)pyridazin-1-ium-3-amine
CID 140660485
6-chloro-N-[(2R)-1-methoxypropan-2-yl]pyridin-2-amine
CID 131065257
6-chloro-N-[2-[2-[2-[(6-chloro-2-pyridinyl)amino]ethoxy]ethoxy]ethyl]pyridin-2-amine
CID 101398050
6-chloro-N-fluoropyridin-2-amine
CID 171556919
6-chloro-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 53410285
N'-(6-chloro-2-pyridinyl)butane-1,4-diamine
CID 117097392
6-chloro-N-(3-ethoxypropyl)pyridin-2-amine
CID 53410274
2-[(6-chloro-2-pyridinyl)amino]-N-ethylacetamide
CID 63588208
6-chloro-N-[(1-methylazetidin-3-yl)methyl]pyridin-2-amine
CID 130783828
6-chloro-N-[2-(4-chlorophenyl)ethyl]pyridin-2-amine
CID 55214934
[4-[[(6-chloro-2-pyridinyl)amino]methyl]phenyl]methanol
CID 106197039

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-methylpropyl)pyridin-2-amine?
The IUPAC name of 6-chloro-N-(2-methylpropyl)pyridin-2-amine (CID 53410300) is 6-chloro-N-(2-methylpropyl)pyridin-2-amine.
What is the SMILES notation for 6-chloro-N-(2-methylpropyl)pyridin-2-amine?
The canonical SMILES for 6-chloro-N-(2-methylpropyl)pyridin-2-amine is CC(C)CNc1cccc(Cl)n1.
What is the InChIKey of 6-chloro-N-(2-methylpropyl)pyridin-2-amine?
The InChIKey is RXXNKHYQCFKFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13ClN2/c1-7(2)6-11-9-5-3-4-8(10)12-9/h3-5,7H,6H2,1-2H3,(H,11,12).
What are the key properties of 6-chloro-N-(2-methylpropyl)pyridin-2-amine?
6-chloro-N-(2-methylpropyl)pyridin-2-amine has a molecular weight of 184.67 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-methylpropyl)pyridin-2-amine is sourced from PubChem (CID 53410300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).