4-chloro-N,2-dimethyl-1H-pyridin-2-amine

C7H11ClN2 — CID 174519142

IUPAC4-chloro-N,2-dimethyl-1H-pyridin-2-amine
SMILESCNC1(C)C=C(Cl)C=CN1
InChIInChI=1S/C7H11ClN2/c1-7(9-2)5-6(8)3-4-10-7/h3-5,9-10H,1-2H3
InChIKeyDGNMLTINMSDINU-UHFFFAOYSA-N
MW158.63 g/mol
LogP1.16
Rot. Bonds1

About 4-chloro-N,2-dimethyl-1H-pyridin-2-amine

4-chloro-N,2-dimethyl-1H-pyridin-2-amine (PubChem CID 174519142) has the molecular formula C7H11ClN2 and a molecular weight of 158.63 g/mol. Its IUPAC name is 4-chloro-N,2-dimethyl-1H-pyridin-2-amine.

Molecular Properties

Compound Name4-chloro-N,2-dimethyl-1H-pyridin-2-amine
PubChem CID174519142
Molecular FormulaC7H11ClN2
Molecular Weight158.63 g/mol
Exact Mass158.06
IUPAC Name4-chloro-N,2-dimethyl-1H-pyridin-2-amine
SMILESCNC1(C)C=C(Cl)C=CN1
InChIInChI=1S/C7H11ClN2/c1-7(9-2)5-6(8)3-4-10-7/h3-5,9-10H,1-2H3
InChIKeyDGNMLTINMSDINU-UHFFFAOYSA-N
XLogP1.16
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.63
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N,2-dimethyl-1H-pyridin-2-amine?
The IUPAC name of 4-chloro-N,2-dimethyl-1H-pyridin-2-amine (CID 174519142) is 4-chloro-N,2-dimethyl-1H-pyridin-2-amine.
What is the SMILES notation for 4-chloro-N,2-dimethyl-1H-pyridin-2-amine?
The canonical SMILES for 4-chloro-N,2-dimethyl-1H-pyridin-2-amine is CNC1(C)C=C(Cl)C=CN1.
What is the InChIKey of 4-chloro-N,2-dimethyl-1H-pyridin-2-amine?
The InChIKey is DGNMLTINMSDINU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11ClN2/c1-7(9-2)5-6(8)3-4-10-7/h3-5,9-10H,1-2H3.
What are the key properties of 4-chloro-N,2-dimethyl-1H-pyridin-2-amine?
4-chloro-N,2-dimethyl-1H-pyridin-2-amine has a molecular weight of 158.63 g/mol, XLogP of 1.16, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N,2-dimethyl-1H-pyridin-2-amine is sourced from PubChem (CID 174519142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).