N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide

C15H14N2O2 — CID 730912

IUPACN-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1oc(-c2ccccc2)cc1C#N
InChIInChI=1S/C15H14N2O2/c1-10(2)14(18)17-15-12(9-16)8-13(19-15)11-6-4-3-5-7-11/h3-8,10H,1-2H3,(H,17,18)
InChIKeyGQAIJIZWHQGHSU-UHFFFAOYSA-N
MW254.29 g/mol
LogP3.41
Rot. Bonds3

About N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide

N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide (PubChem CID 730912) has the molecular formula C15H14N2O2 and a molecular weight of 254.29 g/mol. Its IUPAC name is N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide
PubChem CID730912
Molecular FormulaC15H14N2O2
Molecular Weight254.29 g/mol
Exact Mass254.11
IUPAC NameN-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide
SMILESCC(C)C(=O)Nc1oc(-c2ccccc2)cc1C#N
InChIInChI=1S/C15H14N2O2/c1-10(2)14(18)17-15-12(9-16)8-13(19-15)11-6-4-3-5-7-11/h3-8,10H,1-2H3,(H,17,18)
InChIKeyGQAIJIZWHQGHSU-UHFFFAOYSA-N
XLogP3.41
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-Amino-4,5-diphenyl-3-furonitrile
CID 389699
(2E)-2-cyano-3-(5-methylfuran-2-yl)-N-(3-methylphenyl)prop-2-enamide
CID 738805
2-chloro-N-[3-cyano-4,5-bis(4-methoxyphenyl)furan-2-yl]acetamide
CID 2382936
N-(4-cyanophenyl)-3-(5-methylfuran-2-yl)propanamide
CID 729147
(2E)-2-cyano-3-(5-methylfuran-2-yl)-N-(4-methylphenyl)prop-2-enamide
CID 738823
N-(3-cyano-4,5-diphenylfuran-2-yl)-4-methoxybenzamide
CID 1204057
2-Amino-5-phenylfuran-3-carbonitrile
CID 693961
(2Z)-N-benzyl-2-cyano-3-[5-(dimethylamino)furan-2-yl]prop-2-enamide
CID 921800
(Z)-N-benzyl-2-cyano-3-[5-(diethylamino)furan-2-yl]prop-2-enamide
CID 929467
N-(3-cyano-5-phenylfuran-2-yl)-4-methylbenzamide
CID 1477449
N-(3-cyano-4,5-diphenyl-2-furyl)-2-(4-morpholinyl)acetamide
CID 2235240
N-[3-cyano-4,5-bis(4-methoxyphenyl)furan-2-yl]acetamide
CID 2305048

Frequently Asked Questions

What is the IUPAC name of N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide?
The IUPAC name of N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide (CID 730912) is N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide.
What is the SMILES notation for N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide?
The canonical SMILES for N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide is CC(C)C(=O)Nc1oc(-c2ccccc2)cc1C#N.
What is the InChIKey of N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide?
The InChIKey is GQAIJIZWHQGHSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2/c1-10(2)14(18)17-15-12(9-16)8-13(19-15)11-6-4-3-5-7-11/h3-8,10H,1-2H3,(H,17,18).
What are the key properties of N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide?
N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide has a molecular weight of 254.29 g/mol, XLogP of 3.41, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyano-5-phenylfuran-2-yl)-2-methylpropanamide is sourced from PubChem (CID 730912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).