N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide

C17H17NO2 — CID 64592060

IUPACN-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide
SMILESO=C(c1ccccc1)N(Cc1cccc(O)c1)C1CC1
InChIInChI=1S/C17H17NO2/c19-16-8-4-5-13(11-16)12-18(15-9-10-15)17(20)14-6-2-1-3-7-14/h1-8,11,15,19H,9-10,12H2
InChIKeyJRDQGMCTAXRECX-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.20
Rot. Bonds4

About N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide

N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide (PubChem CID 64592060) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide
PubChem CID64592060
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC NameN-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide
SMILESO=C(c1ccccc1)N(Cc1cccc(O)c1)C1CC1
InChIInChI=1S/C17H17NO2/c19-16-8-4-5-13(11-16)12-18(15-9-10-15)17(20)14-6-2-1-3-7-14/h1-8,11,15,19H,9-10,12H2
InChIKeyJRDQGMCTAXRECX-UHFFFAOYSA-N
XLogP3.20
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 71935827
3-amino-N-benzyl-N-cyclopropylbenzamide
CID 43574369
2-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]acetamide
CID 60964232
5-bromo-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]pyridine-2-carboxamide
CID 62954767
2-bromo-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]-2-methylpropanamide
CID 114328289
N-cyclopropyl-4-(3,6-dimethylpyrazin-2-yl)-N-[(3-hydroxyphenyl)methyl]benzamide
CID 121499615
2-bromo-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]furan-3-carboxamide
CID 106853582
N-benzyl-4-(bromomethyl)-N-cyclopropylbenzamide
CID 102850934
2-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]cyclopropane-1-carboxamide
CID 114997619
N-benzyl-N-(oxetan-3-yl)benzamide
CID 166264927
3-[cyclopropyl-[(3-hydroxyphenyl)methyl]amino]propanoic acid
CID 65054828
4-bromo-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]-1-methylpyrrole-2-carboxamide
CID 60956180

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide?
The IUPAC name of N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide (CID 64592060) is N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide.
What is the SMILES notation for N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide?
The canonical SMILES for N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide is O=C(c1ccccc1)N(Cc1cccc(O)c1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide?
The InChIKey is JRDQGMCTAXRECX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c19-16-8-4-5-13(11-16)12-18(15-9-10-15)17(20)14-6-2-1-3-7-14/h1-8,11,15,19H,9-10,12H2.
What are the key properties of N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide?
N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide has a molecular weight of 267.33 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide is sourced from PubChem (CID 64592060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).