N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide

C18H19NO2 — CID 71935827

IUPACN-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
SMILESO=C(Cc1cccc(O)c1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C18H19NO2/c20-17-8-4-7-15(11-17)12-18(21)19(16-9-10-16)13-14-5-2-1-3-6-14/h1-8,11,16,20H,9-10,12-13H2
InChIKeySWIPDAKERBTMEJ-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.13
Rot. Bonds5

About N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide

N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide (PubChem CID 71935827) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
PubChem CID71935827
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC NameN-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
SMILESO=C(Cc1cccc(O)c1)N(Cc1ccccc1)C1CC1
InChIInChI=1S/C18H19NO2/c20-17-8-4-7-15(11-17)12-18(21)19(16-9-10-16)13-14-5-2-1-3-6-14/h1-8,11,16,20H,9-10,12-13H2
InChIKeySWIPDAKERBTMEJ-UHFFFAOYSA-N
XLogP3.13
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromoethyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 80678119
2-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]acetamide
CID 60964232
N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]benzamide
CID 64592060
N-(3-aminopropyl)-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide
CID 61399131
N-benzyl-2-(3-bromo-4-fluorophenyl)-N-cyclopropylacetamide
CID 60526454
6-amino-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]hexanamide
CID 60964131
2-bromo-N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]-2-methylpropanamide
CID 114328289
N-cyclopropyl-N-[(3-hydroxyphenyl)methyl]-2-propoxyacetamide
CID 103801005
N-cyclopentyl-2-(3-hydroxyphenyl)-N-(3,3,3-trifluoropropyl)acetamide
CID 71968977
3-[2-[cyclopropyl-[(4-nitrophenyl)methyl]amino]-2-oxoethyl]benzoic acid
CID 120690673
N-(2-chloroethyl)-N-cyclopropyl-2-phenylacetamide
CID 63394434
N-benzyl-N-cyclopropyl-3,3-diphenylpropanamide
CID 55549162

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide (CID 71935827) is N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide is O=C(Cc1cccc(O)c1)N(Cc1ccccc1)C1CC1.
What is the InChIKey of N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
The InChIKey is SWIPDAKERBTMEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO2/c20-17-8-4-7-15(11-17)12-18(21)19(16-9-10-16)13-14-5-2-1-3-6-14/h1-8,11,16,20H,9-10,12-13H2.
What are the key properties of N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide?
N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide has a molecular weight of 281.36 g/mol, XLogP of 3.13, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-cyclopropyl-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 71935827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).