4-chloro-2-propan-2-ylpyridin-3-amine

C8H11ClN2 — CID 134168279

IUPAC4-chloro-2-propan-2-ylpyridin-3-amine
SMILESCC(C)c1nccc(Cl)c1N
InChIInChI=1S/C8H11ClN2/c1-5(2)8-7(10)6(9)3-4-11-8/h3-5H,10H2,1-2H3
InChIKeyHNLNICWOZQXGGA-UHFFFAOYSA-N
MW170.64 g/mol
LogP2.44
Rot. Bonds1

About 4-chloro-2-propan-2-ylpyridin-3-amine

4-chloro-2-propan-2-ylpyridin-3-amine (PubChem CID 134168279) has the molecular formula C8H11ClN2 and a molecular weight of 170.64 g/mol. Its IUPAC name is 4-chloro-2-propan-2-ylpyridin-3-amine.

Molecular Properties

Compound Name4-chloro-2-propan-2-ylpyridin-3-amine
PubChem CID134168279
Molecular FormulaC8H11ClN2
Molecular Weight170.64 g/mol
Exact Mass170.06
IUPAC Name4-chloro-2-propan-2-ylpyridin-3-amine
SMILESCC(C)c1nccc(Cl)c1N
InChIInChI=1S/C8H11ClN2/c1-5(2)8-7(10)6(9)3-4-11-8/h3-5H,10H2,1-2H3
InChIKeyHNLNICWOZQXGGA-UHFFFAOYSA-N
XLogP2.44
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.64
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-propan-2-ylpyridin-3-amine?
The IUPAC name of 4-chloro-2-propan-2-ylpyridin-3-amine (CID 134168279) is 4-chloro-2-propan-2-ylpyridin-3-amine.
What is the SMILES notation for 4-chloro-2-propan-2-ylpyridin-3-amine?
The canonical SMILES for 4-chloro-2-propan-2-ylpyridin-3-amine is CC(C)c1nccc(Cl)c1N.
What is the InChIKey of 4-chloro-2-propan-2-ylpyridin-3-amine?
The InChIKey is HNLNICWOZQXGGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClN2/c1-5(2)8-7(10)6(9)3-4-11-8/h3-5H,10H2,1-2H3.
What are the key properties of 4-chloro-2-propan-2-ylpyridin-3-amine?
4-chloro-2-propan-2-ylpyridin-3-amine has a molecular weight of 170.64 g/mol, XLogP of 2.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-propan-2-ylpyridin-3-amine is sourced from PubChem (CID 134168279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).