N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine

C15H12ClFN2O — CID 71929736

IUPACN-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine
SMILESCN(Cc1c(F)cccc1Cl)c1nccc2occc12
InChIInChI=1S/C15H12ClFN2O/c1-19(9-11-12(16)3-2-4-13(11)17)15-10-6-8-20-14(10)5-7-18-15/h2-8H,9H2,1H3
InChIKeyXIYBTCHBMVKBPN-UHFFFAOYSA-N
MW290.73 g/mol
LogP4.26
Rot. Bonds3

About N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine

N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine (PubChem CID 71929736) has the molecular formula C15H12ClFN2O and a molecular weight of 290.73 g/mol. Its IUPAC name is N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine.

Molecular Properties

Compound NameN-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine
PubChem CID71929736
Molecular FormulaC15H12ClFN2O
Molecular Weight290.73 g/mol
Exact Mass290.06
IUPAC NameN-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine
SMILESCN(Cc1c(F)cccc1Cl)c1nccc2occc12
InChIInChI=1S/C15H12ClFN2O/c1-19(9-11-12(16)3-2-4-13(11)17)15-10-6-8-20-14(10)5-7-18-15/h2-8H,9H2,1H3
InChIKeyXIYBTCHBMVKBPN-UHFFFAOYSA-N
XLogP4.26
TPSA29.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.73
LogP ≤ 54.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[furo[3,2-c]pyridin-4-yl(methyl)amino]propan-2-ol
CID 91662123
N-ethyl-N'-furo[3,2-c]pyridin-4-yl-N'-methylethane-1,2-diamine
CID 106535603
N-[(2-chloro-6-fluorophenyl)methyl]-N,3-dimethyl-5-nitropyridin-2-amine
CID 56571004
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide
CID 60628558
2-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylpyridine-4-sulfonamide
CID 61050922
5-[[(2-chloro-6-fluorophenyl)methyl-methylamino]methyl]-1,3-thiazol-2-amine
CID 120897457
2-[furo[3,2-c]pyridin-4-yl(methyl)amino]propan-1-ol
CID 103873021
5-chloro-4-[(2-chloro-6-fluorophenyl)methyl-methylamino]-1H-pyridazin-6-one
CID 18095470
1-[(2-chloro-6-fluorophenyl)methyl-methylamino]propan-2-ol
CID 62333927
N-[(2-chloro-6-fluorophenyl)methyl]-N-methyl-4-pyrazol-1-ylbenzamide
CID 9171384
2-bromo-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylpyridine-3-carboxamide
CID 103753872
(2S)-1-[(2-chloro-6-fluorophenyl)methyl-methylamino]-3-(2,6-dichlorophenoxy)propan-2-ol
CID 2090777

Frequently Asked Questions

What is the IUPAC name of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine?
The IUPAC name of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine (CID 71929736) is N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine.
What is the SMILES notation for N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine?
The canonical SMILES for N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine is CN(Cc1c(F)cccc1Cl)c1nccc2occc12.
What is the InChIKey of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine?
The InChIKey is XIYBTCHBMVKBPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFN2O/c1-19(9-11-12(16)3-2-4-13(11)17)15-10-6-8-20-14(10)5-7-18-15/h2-8H,9H2,1H3.
What are the key properties of N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine?
N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine has a molecular weight of 290.73 g/mol, XLogP of 4.26, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chloro-6-fluorophenyl)methyl]-N-methylfuro[3,2-c]pyridin-4-amine is sourced from PubChem (CID 71929736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).