(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile

C19H16N2O — CID 11818553

IUPAC(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile
SMILESN#C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccco1
InChIInChI=1S/C19H16N2O/c20-14-17(18-12-7-13-22-18)21-19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13,17,19,21H/t17-/m1/s1
InChIKeyCWYBIBLWQLXKAJ-QGZVFWFLSA-N
MW288.35 g/mol
LogP4.22
Rot. Bonds5

About (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile

(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile (PubChem CID 11818553) has the molecular formula C19H16N2O and a molecular weight of 288.35 g/mol. Its IUPAC name is (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile.

Molecular Properties

Compound Name(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile
PubChem CID11818553
Molecular FormulaC19H16N2O
Molecular Weight288.35 g/mol
Exact Mass288.13
IUPAC Name(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile
SMILESN#C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccco1
InChIInChI=1S/C19H16N2O/c20-14-17(18-12-7-13-22-18)21-19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13,17,19,21H/t17-/m1/s1
InChIKeyCWYBIBLWQLXKAJ-QGZVFWFLSA-N
XLogP4.22
TPSA48.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-(furan-2-yl)-2-[[(2-methylphenyl)-phenylmethyl]amino]acetonitrile
CID 177499858
2-(furan-2-yl)-2-(iodoamino)acetonitrile
CID 146552435
(2R)-2-(benzhydrylamino)-2-(4-methylphenyl)acetonitrile
CID 71293872
(1R)-1-(furan-2-yl)-N-[furan-2-yl(phenyl)methyl]ethanamine
CID 81402613
(1R)-N-[1-(furan-2-yl)ethyl]-1-phenylethanamine
CID 81351264
N-[1-(furan-2-yl)ethyl]-1-phenylethanamine
CID 43177136
2-(benzhydrylamino)-2-(2-fluorophenyl)acetonitrile
CID 59412400
(2R)-2-[bis(4-methoxyphenyl)methylamino]-2-phenylacetonitrile
CID 101059199
(2S)-2-(benzhydrylamino)-2-(1,3-benzodioxol-5-yl)acetonitrile
CID 101483032
2-(furan-2-yl)-2-(3-methylbutylamino)acetonitrile
CID 55263890
N-[cyano(furan-2-yl)methyl]-2,2-dimethylpropanamide
CID 13075793
N-[furan-2-yl(phenyl)methyl]-3-methylpentan-2-amine
CID 60780727

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile?
The IUPAC name of (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile (CID 11818553) is (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile.
What is the SMILES notation for (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile?
The canonical SMILES for (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile is N#C[C@@H](NC(c1ccccc1)c1ccccc1)c1ccco1.
What is the InChIKey of (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile?
The InChIKey is CWYBIBLWQLXKAJ-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H16N2O/c20-14-17(18-12-7-13-22-18)21-19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13,17,19,21H/t17-/m1/s1.
What are the key properties of (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile?
(2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile has a molecular weight of 288.35 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(benzhydrylamino)-2-(furan-2-yl)acetonitrile is sourced from PubChem (CID 11818553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).