N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine

C10H13FN2 — CID 127002217

IUPACN-cyclobutyl-5-fluoro-N-methylpyridin-3-amine
SMILESCN(c1cncc(F)c1)C1CCC1
InChIInChI=1S/C10H13FN2/c1-13(9-3-2-4-9)10-5-8(11)6-12-7-10/h5-7,9H,2-4H2,1H3
InChIKeyMBYURTDUOMXGRG-UHFFFAOYSA-N
MW180.23 g/mol
LogP2.21
Rot. Bonds2

About N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine

N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine (PubChem CID 127002217) has the molecular formula C10H13FN2 and a molecular weight of 180.23 g/mol. Its IUPAC name is N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine.

Molecular Properties

Compound NameN-cyclobutyl-5-fluoro-N-methylpyridin-3-amine
PubChem CID127002217
Molecular FormulaC10H13FN2
Molecular Weight180.23 g/mol
Exact Mass180.11
IUPAC NameN-cyclobutyl-5-fluoro-N-methylpyridin-3-amine
SMILESCN(c1cncc(F)c1)C1CCC1
InChIInChI=1S/C10H13FN2/c1-13(9-3-2-4-9)10-5-8(11)6-12-7-10/h5-7,9H,2-4H2,1H3
InChIKeyMBYURTDUOMXGRG-UHFFFAOYSA-N
XLogP2.21
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 52.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine?
The IUPAC name of N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine (CID 127002217) is N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine.
What is the SMILES notation for N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine?
The canonical SMILES for N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine is CN(c1cncc(F)c1)C1CCC1.
What is the InChIKey of N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine?
The InChIKey is MBYURTDUOMXGRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2/c1-13(9-3-2-4-9)10-5-8(11)6-12-7-10/h5-7,9H,2-4H2,1H3.
What are the key properties of N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine?
N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine has a molecular weight of 180.23 g/mol, XLogP of 2.21, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-5-fluoro-N-methylpyridin-3-amine is sourced from PubChem (CID 127002217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).