N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide

C18H17NO2 — CID 9302248

IUPACN-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide
SMILESC[C@@H](CNC(=O)c1cc2ccccc2o1)c1ccccc1
InChIInChI=1S/C18H17NO2/c1-13(14-7-3-2-4-8-14)12-19-18(20)17-11-15-9-5-6-10-16(15)21-17/h2-11,13H,12H2,1H3,(H,19,20)/t13-/m0/s1
InChIKeyXMDYSFARFHXNNP-ZDUSSCGKSA-N
MW279.34 g/mol
LogP3.97
Rot. Bonds4

About N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide

N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide (PubChem CID 9302248) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide
PubChem CID9302248
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC NameN-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide
SMILESC[C@@H](CNC(=O)c1cc2ccccc2o1)c1ccccc1
InChIInChI=1S/C18H17NO2/c1-13(14-7-3-2-4-8-14)12-19-18(20)17-11-15-9-5-6-10-16(15)21-17/h2-11,13H,12H2,1H3,(H,19,20)/t13-/m0/s1
InChIKeyXMDYSFARFHXNNP-ZDUSSCGKSA-N
XLogP3.97
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide
CID 9427401
N-[(2S)-2-amino-2-phenylethyl]-1-benzofuran-2-carboxamide
CID 150997977
N-(2-chloropropyl)-1-benzofuran-2-carboxamide
CID 114296217
N-(2-aminopropyl)-1-benzofuran-2-carboxamide;hydrochloride
CID 69484360
N-[(2R)-2-amino-3-methylbutyl]-1-benzofuran-2-carboxamide;hydrochloride
CID 69484472
N-(4-amino-2-methylbutyl)-1-benzofuran-2-carboxamide
CID 66089049
N-(4-bromo-2-methylbutyl)-1-benzofuran-2-carboxamide
CID 113276116
N-[(2R)-2-(ethylamino)propyl]-1-benzofuran-2-carboxamide;hydrochloride
CID 120654614
N-[2-(2-hydroxyethyl)-4-methylpentyl]-1-benzofuran-2-carboxamide
CID 111662507
N-(2-chloro-3-methoxypropyl)-1-benzofuran-2-carboxamide
CID 113271992
N-[2-(propan-2-ylamino)ethyl]-1-benzofuran-2-carboxamide
CID 62659751
N-benzhydryl-1-benzofuran-2-carboxamide
CID 880613

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide?
The IUPAC name of N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide (CID 9302248) is N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide?
The canonical SMILES for N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide is C[C@@H](CNC(=O)c1cc2ccccc2o1)c1ccccc1.
What is the InChIKey of N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide?
The InChIKey is XMDYSFARFHXNNP-ZDUSSCGKSA-N. The full InChI is InChI=1S/C18H17NO2/c1-13(14-7-3-2-4-8-14)12-19-18(20)17-11-15-9-5-6-10-16(15)21-17/h2-11,13H,12H2,1H3,(H,19,20)/t13-/m0/s1.
What are the key properties of N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide?
N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide has a molecular weight of 279.34 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-phenylpropyl]-1-benzofuran-2-carboxamide is sourced from PubChem (CID 9302248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).