N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide

C14H15NO2 — CID 768448

IUPACN-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide
SMILESC[C@@H](Cc1ccccc1)NC(=O)c1ccco1
InChIInChI=1S/C14H15NO2/c1-11(10-12-6-3-2-4-7-12)15-14(16)13-8-5-9-17-13/h2-9,11H,10H2,1H3,(H,15,16)/t11-/m0/s1
InChIKeyHQBLYOPXFMIQNV-NSHDSACASA-N
MW229.28 g/mol
LogP2.64
Rot. Bonds4

About N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide

N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide (PubChem CID 768448) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide
PubChem CID768448
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC NameN-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide
SMILESC[C@@H](Cc1ccccc1)NC(=O)c1ccco1
InChIInChI=1S/C14H15NO2/c1-11(10-12-6-3-2-4-7-12)15-14(16)13-8-5-9-17-13/h2-9,11H,10H2,1H3,(H,15,16)/t11-/m0/s1
InChIKeyHQBLYOPXFMIQNV-NSHDSACASA-N
XLogP2.64
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[[2-(furan-2-carbonylamino)-3-phenylpropanoyl]amino]butanoic acid
CID 119220848
N-[1-(5-methylhexan-2-ylamino)-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 78768077
(2S)-2-(furan-2-carbonylamino)propanoic acid
CID 792932
N-[(2R)-1-[2-(2-methylpropanoylamino)ethylamino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 31011970
N-[1-(1-benzothiophen-3-yl)propan-2-yl]furan-2-carboxamide
CID 119106138
ethyl 2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 43877560
N-(1,1-diphenylpropan-2-yl)furan-2-carboxamide
CID 46432017
N-[(2S)-1-oxo-3-phenyl-1-(prop-2-ynylamino)propan-2-yl]furan-2-carboxamide
CID 30600892
N-[1-(furan-2-yl)propan-2-yl]benzamide
CID 47148390
N-(4-amino-4-hydroxyiminobutan-2-yl)furan-2-carboxamide
CID 76934841
[2-oxo-2-(propan-2-ylamino)ethyl] (2S)-2-(furan-2-carbonylamino)-3-phenylpropanoate
CID 7567017
N-[1-(cyanomethylamino)-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 71934697

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide (CID 768448) is N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide is C[C@@H](Cc1ccccc1)NC(=O)c1ccco1.
What is the InChIKey of N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide?
The InChIKey is HQBLYOPXFMIQNV-NSHDSACASA-N. The full InChI is InChI=1S/C14H15NO2/c1-11(10-12-6-3-2-4-7-12)15-14(16)13-8-5-9-17-13/h2-9,11H,10H2,1H3,(H,15,16)/t11-/m0/s1.
What are the key properties of N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide?
N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide has a molecular weight of 229.28 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-phenylpropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 768448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).