(2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile

C19H14N2O — CID 11161967

IUPAC(2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile
SMILESN#C[C@H](NC1c2ccccc2-c2ccccc21)c1ccoc1
InChIInChI=1S/C19H14N2O/c20-11-18(13-9-10-22-12-13)21-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-10,12,18-19,21H/t18-/m0/s1
InChIKeyYRECLDIGZJDNEM-SFHVURJKSA-N
MW286.33 g/mol
LogP4.20
Rot. Bonds3

About (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile

(2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile (PubChem CID 11161967) has the molecular formula C19H14N2O and a molecular weight of 286.33 g/mol. Its IUPAC name is (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile.

Molecular Properties

Compound Name(2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile
PubChem CID11161967
Molecular FormulaC19H14N2O
Molecular Weight286.33 g/mol
Exact Mass286.11
IUPAC Name(2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile
SMILESN#C[C@H](NC1c2ccccc2-c2ccccc21)c1ccoc1
InChIInChI=1S/C19H14N2O/c20-11-18(13-9-10-22-12-13)21-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-10,12,18-19,21H/t18-/m0/s1
InChIKeyYRECLDIGZJDNEM-SFHVURJKSA-N
XLogP4.20
TPSA48.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile?
The IUPAC name of (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile (CID 11161967) is (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile.
What is the SMILES notation for (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile?
The canonical SMILES for (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile is N#C[C@H](NC1c2ccccc2-c2ccccc21)c1ccoc1.
What is the InChIKey of (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile?
The InChIKey is YRECLDIGZJDNEM-SFHVURJKSA-N. The full InChI is InChI=1S/C19H14N2O/c20-11-18(13-9-10-22-12-13)21-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-10,12,18-19,21H/t18-/m0/s1.
What are the key properties of (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile?
(2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile has a molecular weight of 286.33 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(9H-fluoren-9-ylamino)-2-(furan-3-yl)acetonitrile is sourced from PubChem (CID 11161967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).