4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine

C12H18FN3 — CID 105390346

IUPAC4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine
SMILESCCCNc1nccc(CNC2CC2)c1F
InChIInChI=1S/C12H18FN3/c1-2-6-14-12-11(13)9(5-7-15-12)8-16-10-3-4-10/h5,7,10,16H,2-4,6,8H2,1H3,(H,14,15)
InChIKeyAEKPEHQSRCYURR-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.29
Rot. Bonds6

About 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine

4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine (PubChem CID 105390346) has the molecular formula C12H18FN3 and a molecular weight of 223.29 g/mol. Its IUPAC name is 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine.

Molecular Properties

Compound Name4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine
PubChem CID105390346
Molecular FormulaC12H18FN3
Molecular Weight223.29 g/mol
Exact Mass223.15
IUPAC Name4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine
SMILESCCCNc1nccc(CNC2CC2)c1F
InChIInChI=1S/C12H18FN3/c1-2-6-14-12-11(13)9(5-7-15-12)8-16-10-3-4-10/h5,7,10,16H,2-4,6,8H2,1H3,(H,14,15)
InChIKeyAEKPEHQSRCYURR-UHFFFAOYSA-N
XLogP2.29
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine with MolForge

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

Launch Full Analysis

Related Compounds

N-[[3-fluoro-2-(4-propylpiperazin-1-yl)-4-pyridinyl]methyl]cyclopropanamine
CID 105388892
N-butan-2-yl-4-[(cyclopropylamino)methyl]-3-fluoro-N-methylpyridin-2-amine
CID 105388956
4-[(cyclopropylamino)methyl]-3-fluoro-N-propyl-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 105389282
N-[[2-(4-ethylpiperidin-1-yl)-3-fluoro-4-pyridinyl]methyl]cyclopropanamine
CID 105389678
N-[(3-fluoro-2-methyl-4-pyridinyl)methyl]piperidin-4-amine
CID 171815594
4-[(cyclopropylamino)methyl]-3-fluoro-N-methyl-N-(2-methylbutyl)pyridin-2-amine
CID 105389047
N-[(2-but-3-enoxy-3-fluoro-4-pyridinyl)methyl]cyclopropanamine
CID 105390750
3-fluoro-N-(oxolan-3-yl)-2-(propylamino)pyridine-4-carboxamide
CID 105386978
N-(1-cyclobutylethyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105387527
N-[[2-(1-ethoxypropan-2-yloxy)-3-fluoro-4-pyridinyl]methyl]cyclopropanamine
CID 103490368
N-[[2-(3-ethylpyrrolidin-1-yl)-3-fluoro-4-pyridinyl]methyl]cyclopropanamine
CID 105390394
N-[[3-fluoro-2-(5-fluoro-2-methylphenoxy)-4-pyridinyl]methyl]cyclopropanamine
CID 102985597

Frequently Asked Questions

What is the IUPAC name of 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine?
The IUPAC name of 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine (CID 105390346) is 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine.
What is the SMILES notation for 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine?
The canonical SMILES for 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine is CCCNc1nccc(CNC2CC2)c1F.
What is the InChIKey of 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine?
The InChIKey is AEKPEHQSRCYURR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18FN3/c1-2-6-14-12-11(13)9(5-7-15-12)8-16-10-3-4-10/h5,7,10,16H,2-4,6,8H2,1H3,(H,14,15).
What are the key properties of 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine?
4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine has a molecular weight of 223.29 g/mol, XLogP of 2.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(cyclopropylamino)methyl]-3-fluoro-N-propylpyridin-2-amine is sourced from PubChem (CID 105390346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).