N-[(1R,2R)-2-phenylcyclopropyl]acetamide

C11H13NO — CID 6954168

IUPACN-[(1R,2R)-2-phenylcyclopropyl]acetamide
SMILESCC(=O)N[C@@H]1C[C@@H]1c1ccccc1
InChIInChI=1S/C11H13NO/c1-8(13)12-11-7-10(11)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)/t10-,11-/m1/s1
InChIKeyOKNYZIGDRLPEEJ-GHMZBOCLSA-N
MW175.23 g/mol
LogP1.68
Rot. Bonds2

About N-[(1R,2R)-2-phenylcyclopropyl]acetamide

N-[(1R,2R)-2-phenylcyclopropyl]acetamide (PubChem CID 6954168) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is N-[(1R,2R)-2-phenylcyclopropyl]acetamide.

Molecular Properties

Compound NameN-[(1R,2R)-2-phenylcyclopropyl]acetamide
PubChem CID6954168
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC NameN-[(1R,2R)-2-phenylcyclopropyl]acetamide
SMILESCC(=O)N[C@@H]1C[C@@H]1c1ccccc1
InChIInChI=1S/C11H13NO/c1-8(13)12-11-7-10(11)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)/t10-,11-/m1/s1
InChIKeyOKNYZIGDRLPEEJ-GHMZBOCLSA-N
XLogP1.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S,2R)-2-phenylcyclopropyl]benzamide
CID 7350127
methyl 2-oxo-2-[(2-phenylcyclopropyl)amino]acetate
CID 112617050
(2S)-2-amino-N-(2-phenylcyclopropyl)propanamide
CID 78977151
2-methyl-3-oxo-3-[(2-phenylcyclopropyl)amino]propanoic acid
CID 114898248
2,3-dimethyl-N-[(1S,2R)-2-phenylcyclopropyl]butanamide
CID 118334207
2,2,2-trifluoro-N-[(1R,2S)-2-phenylcyclopropyl]acetamide
CID 92859467
2-amino-2-methyl-N-(2-phenylcyclopropyl)propanamide;hydrochloride
CID 119281635
tert-butyl N-[(1S)-2-phenylcyclopropyl]carbamate
CID 58486461
2-amino-N-(2-phenylcyclopropyl)cyclopropane-1-carboxamide
CID 114995959
tert-butyl N-[(1S,2R)-2-phenylcyclopropyl]carbamate;carbonic acid
CID 70980362
6-methyl-N-[(1R,2S)-2-phenylcyclopropyl]pyridine-3-carboxamide
CID 73011269
4-methyl-N-(2-phenylcyclopropyl)piperidine-1-carboxamide
CID 60586425

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2R)-2-phenylcyclopropyl]acetamide?
The IUPAC name of N-[(1R,2R)-2-phenylcyclopropyl]acetamide (CID 6954168) is N-[(1R,2R)-2-phenylcyclopropyl]acetamide.
What is the SMILES notation for N-[(1R,2R)-2-phenylcyclopropyl]acetamide?
The canonical SMILES for N-[(1R,2R)-2-phenylcyclopropyl]acetamide is CC(=O)N[C@@H]1C[C@@H]1c1ccccc1.
What is the InChIKey of N-[(1R,2R)-2-phenylcyclopropyl]acetamide?
The InChIKey is OKNYZIGDRLPEEJ-GHMZBOCLSA-N. The full InChI is InChI=1S/C11H13NO/c1-8(13)12-11-7-10(11)9-5-3-2-4-6-9/h2-6,10-11H,7H2,1H3,(H,12,13)/t10-,11-/m1/s1.
What are the key properties of N-[(1R,2R)-2-phenylcyclopropyl]acetamide?
N-[(1R,2R)-2-phenylcyclopropyl]acetamide has a molecular weight of 175.23 g/mol, XLogP of 1.68, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2R)-2-phenylcyclopropyl]acetamide is sourced from PubChem (CID 6954168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).