N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine

C16H20FN3 — CID 62295514

IUPACN-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCC(C)NCc1ccnc(N(C)c2ccccc2F)c1
InChIInChI=1S/C16H20FN3/c1-12(2)19-11-13-8-9-18-16(10-13)20(3)15-7-5-4-6-14(15)17/h4-10,12,19H,11H2,1-3H3
InChIKeyACZFBFDNKPSBBZ-UHFFFAOYSA-N
MW273.35 g/mol
LogP3.49
Rot. Bonds5

About N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine

N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine (PubChem CID 62295514) has the molecular formula C16H20FN3 and a molecular weight of 273.35 g/mol. Its IUPAC name is N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
PubChem CID62295514
Molecular FormulaC16H20FN3
Molecular Weight273.35 g/mol
Exact Mass273.16
IUPAC NameN-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
SMILESCC(C)NCc1ccnc(N(C)c2ccccc2F)c1
InChIInChI=1S/C16H20FN3/c1-12(2)19-11-13-8-9-18-16(10-13)20(3)15-7-5-4-6-14(15)17/h4-10,12,19H,11H2,1-3H3
InChIKeyACZFBFDNKPSBBZ-UHFFFAOYSA-N
XLogP3.49
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-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-ethyl-N-(2-fluorophenyl)-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62283918
4-[(tert-butylamino)methyl]-N-(2-fluorophenyl)-N-methylpyridin-2-amine
CID 62292871
N-(2,4-dimethylphenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62294689
N-[[2-[(2-fluorophenyl)methoxy]-4-pyridinyl]methyl]propan-2-amine
CID 63937965
N-methyl-N-[(2-methylphenyl)methyl]-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62287039
2-fluoro-N-methyl-N-[[4-[(propan-2-ylamino)methyl]phenyl]methyl]aniline
CID 62434557
2-fluoro-N,N-dimethyl-5-[(propan-2-ylamino)methyl]aniline
CID 84753813
N-butyl-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62285974
N-[[2-(3-fluorophenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 62321474
N-methyl-4-[(2-methylpropylamino)methyl]-N-phenylpyridin-2-amine
CID 62286623
N-ethyl-2-fluoro-N-[4-[(propan-2-ylamino)methyl]phenyl]aniline
CID 63552892
N-(3-fluorophenyl)-N-methyl-4-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62292926

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
The IUPAC name of N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine (CID 62295514) is N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine is CC(C)NCc1ccnc(N(C)c2ccccc2F)c1.
What is the InChIKey of N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
The InChIKey is ACZFBFDNKPSBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3/c1-12(2)19-11-13-8-9-18-16(10-13)20(3)15-7-5-4-6-14(15)17/h4-10,12,19H,11H2,1-3H3.
What are the key properties of N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine?
N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine has a molecular weight of 273.35 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-N-methyl-4-[(propan-2-ylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62295514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).