N-[2-(cyclopropylmethyl)phenyl]benzamide

C17H17NO — CID 91703615

IUPACN-[2-(cyclopropylmethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1CC1CC1)c1ccccc1
InChIInChI=1S/C17H17NO/c19-17(14-6-2-1-3-7-14)18-16-9-5-4-8-15(16)12-13-10-11-13/h1-9,13H,10-12H2,(H,18,19)
InChIKeySODGSSMQRBOLGA-UHFFFAOYSA-N
MW251.33 g/mol
LogP3.89
Rot. Bonds4

About N-[2-(cyclopropylmethyl)phenyl]benzamide

N-[2-(cyclopropylmethyl)phenyl]benzamide (PubChem CID 91703615) has the molecular formula C17H17NO and a molecular weight of 251.33 g/mol. Its IUPAC name is N-[2-(cyclopropylmethyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-(cyclopropylmethyl)phenyl]benzamide
PubChem CID91703615
Molecular FormulaC17H17NO
Molecular Weight251.33 g/mol
Exact Mass251.13
IUPAC NameN-[2-(cyclopropylmethyl)phenyl]benzamide
SMILESO=C(Nc1ccccc1CC1CC1)c1ccccc1
InChIInChI=1S/C17H17NO/c19-17(14-6-2-1-3-7-14)18-16-9-5-4-8-15(16)12-13-10-11-13/h1-9,13H,10-12H2,(H,18,19)
InChIKeySODGSSMQRBOLGA-UHFFFAOYSA-N
XLogP3.89
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopropylmethyl)phenyl]benzamide?
The IUPAC name of N-[2-(cyclopropylmethyl)phenyl]benzamide (CID 91703615) is N-[2-(cyclopropylmethyl)phenyl]benzamide.
What is the SMILES notation for N-[2-(cyclopropylmethyl)phenyl]benzamide?
The canonical SMILES for N-[2-(cyclopropylmethyl)phenyl]benzamide is O=C(Nc1ccccc1CC1CC1)c1ccccc1.
What is the InChIKey of N-[2-(cyclopropylmethyl)phenyl]benzamide?
The InChIKey is SODGSSMQRBOLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO/c19-17(14-6-2-1-3-7-14)18-16-9-5-4-8-15(16)12-13-10-11-13/h1-9,13H,10-12H2,(H,18,19).
What are the key properties of N-[2-(cyclopropylmethyl)phenyl]benzamide?
N-[2-(cyclopropylmethyl)phenyl]benzamide has a molecular weight of 251.33 g/mol, XLogP of 3.89, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopropylmethyl)phenyl]benzamide is sourced from PubChem (CID 91703615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).