2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide

C16H16N2O2 — CID 62876840

IUPAC2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide
SMILESCC(Cc1ccco1)NC(=O)C(C#N)c1ccccc1
InChIInChI=1S/C16H16N2O2/c1-12(10-14-8-5-9-20-14)18-16(19)15(11-17)13-6-3-2-4-7-13/h2-9,12,15H,10H2,1H3,(H,18,19)
InChIKeyJVIJNHMRRNBDMM-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.63
Rot. Bonds5

About 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide

2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide (PubChem CID 62876840) has the molecular formula C16H16N2O2 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide.

Molecular Properties

Compound Name2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide
PubChem CID62876840
Molecular FormulaC16H16N2O2
Molecular Weight268.32 g/mol
Exact Mass268.12
IUPAC Name2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide
SMILESCC(Cc1ccco1)NC(=O)C(C#N)c1ccccc1
InChIInChI=1S/C16H16N2O2/c1-12(10-14-8-5-9-20-14)18-16(19)15(11-17)13-6-3-2-4-7-13/h2-9,12,15H,10H2,1H3,(H,18,19)
InChIKeyJVIJNHMRRNBDMM-UHFFFAOYSA-N
XLogP2.63
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-cyano-N-(furan-2-ylmethyl)-2-phenylacetamide
CID 951669
1-[2-[(2S)-2-cyanopropyl]sulfanylphenyl]-3-[(2R)-1-(furan-2-yl)propan-2-yl]urea
CID 95308178
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
3-chloro-N-[1-(furan-2-yl)propan-2-yl]-2-methylpropanamide
CID 62728492
(2R)-N-[(2R)-1-(furan-2-yl)propan-2-yl]-2-methylsulfonylpropanamide
CID 94171682
2-anilino-N-[1-(furan-2-yl)propan-2-yl]acetamide
CID 60861599
2-amino-N-[1-(furan-2-yl)propan-2-yl]pentanamide
CID 43705248
N-[1-(furan-2-yl)propan-2-yl]-2-phenoxyacetamide
CID 47148392
1-cyano-N-[1-(furan-2-yl)propan-2-yl]cyclohexane-1-carboxamide
CID 61461953
(2S)-2-amino-N-[1-(furan-2-yl)propan-2-yl]hexanamide
CID 103950106
2-cyano-N-ethyl-2-phenylacetamide
CID 62877347
2,2-diphenyl-N-[(2R)-1-phenylpropan-2-yl]acetamide
CID 1375536

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide?
The IUPAC name of 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide (CID 62876840) is 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide.
What is the SMILES notation for 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide?
The canonical SMILES for 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide is CC(Cc1ccco1)NC(=O)C(C#N)c1ccccc1.
What is the InChIKey of 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide?
The InChIKey is JVIJNHMRRNBDMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O2/c1-12(10-14-8-5-9-20-14)18-16(19)15(11-17)13-6-3-2-4-7-13/h2-9,12,15H,10H2,1H3,(H,18,19).
What are the key properties of 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide?
2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide has a molecular weight of 268.32 g/mol, XLogP of 2.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[1-(furan-2-yl)propan-2-yl]-2-phenylacetamide is sourced from PubChem (CID 62876840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).