5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine

C10H12ClFN2 — CID 79727577

IUPAC5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine
SMILESCN(CC1CC1)c1ncc(Cl)cc1F
InChIInChI=1S/C10H12ClFN2/c1-14(6-7-2-3-7)10-9(12)4-8(11)5-13-10/h4-5,7H,2-3,6H2,1H3
InChIKeyZMNFRBFYHQJHID-UHFFFAOYSA-N
MW214.67 g/mol
LogP2.72
Rot. Bonds3

About 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine

5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine (PubChem CID 79727577) has the molecular formula C10H12ClFN2 and a molecular weight of 214.67 g/mol. Its IUPAC name is 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine
PubChem CID79727577
Molecular FormulaC10H12ClFN2
Molecular Weight214.67 g/mol
Exact Mass214.07
IUPAC Name5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine
SMILESCN(CC1CC1)c1ncc(Cl)cc1F
InChIInChI=1S/C10H12ClFN2/c1-14(6-7-2-3-7)10-9(12)4-8(11)5-13-10/h4-5,7H,2-3,6H2,1H3
InChIKeyZMNFRBFYHQJHID-UHFFFAOYSA-N
XLogP2.72
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.67
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine?
The IUPAC name of 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine (CID 79727577) is 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine.
What is the SMILES notation for 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine?
The canonical SMILES for 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine is CN(CC1CC1)c1ncc(Cl)cc1F.
What is the InChIKey of 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine?
The InChIKey is ZMNFRBFYHQJHID-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClFN2/c1-14(6-7-2-3-7)10-9(12)4-8(11)5-13-10/h4-5,7H,2-3,6H2,1H3.
What are the key properties of 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine?
5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine has a molecular weight of 214.67 g/mol, XLogP of 2.72, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(cyclopropylmethyl)-3-fluoro-N-methylpyridin-2-amine is sourced from PubChem (CID 79727577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).