2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide

C18H14F3N3O2 — CID 14687901

IUPAC2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(-c2ccccc2)nc1NCc1ccco1
InChIInChI=1S/C18H14F3N3O2/c19-18(20,21)13-9-14(11-5-2-1-3-6-11)24-17(15(13)16(22)25)23-10-12-7-4-8-26-12/h1-9H,10H2,(H2,22,25)(H,23,24)
InChIKeyAVJPOKAHVVHWPO-UHFFFAOYSA-N
MW361.32 g/mol
LogP4.07
Rot. Bonds5

About 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide

2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide (PubChem CID 14687901) has the molecular formula C18H14F3N3O2 and a molecular weight of 361.32 g/mol. Its IUPAC name is 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide
PubChem CID14687901
Molecular FormulaC18H14F3N3O2
Molecular Weight361.32 g/mol
Exact Mass361.10
IUPAC Name2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide
SMILESNC(=O)c1c(C(F)(F)F)cc(-c2ccccc2)nc1NCc1ccco1
InChIInChI=1S/C18H14F3N3O2/c19-18(20,21)13-9-14(11-5-2-1-3-6-11)24-17(15(13)16(22)25)23-10-12-7-4-8-26-12/h1-9H,10H2,(H2,22,25)(H,23,24)
InChIKeyAVJPOKAHVVHWPO-UHFFFAOYSA-N
XLogP4.07
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.32
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-Amino-6-furan-2-yl-4-phenyl-nicotinonitrile
CID 24950370
N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)acetamide
CID 46880333
N-(2-(furan-2-yl)-3,4''-bipyridin-6-yl)cyclopropanecarboxamide
CID 46866591
N-[5-(3-fluoro-4-pyridinyl)-6-(furan-2-yl)-2-pyridinyl]cyclopropanecarboxamide
CID 46866593
1-ethyl-N-(furan-2-ylmethyl)-7-methyl-4-oxo-1,4-dihydro-1,8-naphthyridine-3-carboxamide
CID 859261
N-[2-(pyridin-2-ylcarbamoyl)phenyl]furan-2-carboxamide
CID 722974
4-Fluoro-N-[3-(1-methyl-piperidin-4-yl)-furo[3,2-b]pyridin-5-yl]-benzamide
CID 9863365
2,4,6-Trifluoro-N-[3-(1-methyl-piperidin-4-yl)-furo[3,2-b]pyridin-5-yl]-benzamide
CID 10000386
2-amino-N-(2-fluorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 11483771
4-Fluoro-N-[6-(2-furyl)-5-pyridin-4-ylpyrazin-2-yl]benzamide
CID 16070216
2-amino-N-(4-fluorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 45267125
2-amino-N-(3-fluorobenzyl)-6-(furan-2-yl)pyrimidine-4-carboxamide
CID 45270541

Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide (CID 14687901) is 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide is NC(=O)c1c(C(F)(F)F)cc(-c2ccccc2)nc1NCc1ccco1.
What is the InChIKey of 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
The InChIKey is AVJPOKAHVVHWPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F3N3O2/c19-18(20,21)13-9-14(11-5-2-1-3-6-11)24-17(15(13)16(22)25)23-10-12-7-4-8-26-12/h1-9H,10H2,(H2,22,25)(H,23,24).
What are the key properties of 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide?
2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide has a molecular weight of 361.32 g/mol, XLogP of 4.07, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethylamino)-6-phenyl-4-(trifluoromethyl)pyridine-3-carboxamide is sourced from PubChem (CID 14687901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).