cyclopropylmethyl 2-benzhydryloxyacetate

C19H20O3 — CID 57147359

IUPACcyclopropylmethyl 2-benzhydryloxyacetate
SMILESO=C(COC(c1ccccc1)c1ccccc1)OCC1CC1
InChIInChI=1S/C19H20O3/c20-18(21-13-15-11-12-15)14-22-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19H,11-14H2
InChIKeyUTJMJDXLLTXAQV-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.75
Rot. Bonds7

About cyclopropylmethyl 2-benzhydryloxyacetate

cyclopropylmethyl 2-benzhydryloxyacetate (PubChem CID 57147359) has the molecular formula C19H20O3 and a molecular weight of 296.37 g/mol. Its IUPAC name is cyclopropylmethyl 2-benzhydryloxyacetate.

Molecular Properties

Compound Namecyclopropylmethyl 2-benzhydryloxyacetate
PubChem CID57147359
Molecular FormulaC19H20O3
Molecular Weight296.37 g/mol
Exact Mass296.14
IUPAC Namecyclopropylmethyl 2-benzhydryloxyacetate
SMILESO=C(COC(c1ccccc1)c1ccccc1)OCC1CC1
InChIInChI=1S/C19H20O3/c20-18(21-13-15-11-12-15)14-22-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19H,11-14H2
InChIKeyUTJMJDXLLTXAQV-UHFFFAOYSA-N
XLogP3.75
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-(cyclopropylmethoxy)-3-oxo-2-phenylpropanoic acid
CID 129239144
cyclopropylmethyl 2-[(2,2-diphenylacetyl)amino]acetate
CID 51133492
cyclopropylmethyl 3-amino-2-phenylpropanoate
CID 62878848
(4-methylphenyl)methyl 2-benzhydryloxyacetate
CID 22159799
[1-(cyclopropylmethoxy)-1-phenylpropan-2-yl] propanoate
CID 155148787
azane;2-benzhydryloxyacetic acid;propane
CID 173385608
cyclohexylmethyl (2S)-2-phenylpropanoate
CID 134967383
N-(2-amino-2-phenylethyl)-2-(cyclopropylmethoxy)acetamide;hydrochloride
CID 119529587
1-[cyclopropylmethoxy(phenyl)methyl]-3-nitrobenzene
CID 118355566
2-[4-(benzhydryloxymethyl)piperidin-1-yl]ethanamine
CID 54215740
2-benzhydryloxy-1-(4-cyclopentylpiperazin-1-yl)ethanone
CID 55583808
2-benzhydryloxy-1-[4-(cyclopentanecarbonyl)piperazin-1-yl]ethanone
CID 36512164

Frequently Asked Questions

What is the IUPAC name of cyclopropylmethyl 2-benzhydryloxyacetate?
The IUPAC name of cyclopropylmethyl 2-benzhydryloxyacetate (CID 57147359) is cyclopropylmethyl 2-benzhydryloxyacetate.
What is the SMILES notation for cyclopropylmethyl 2-benzhydryloxyacetate?
The canonical SMILES for cyclopropylmethyl 2-benzhydryloxyacetate is O=C(COC(c1ccccc1)c1ccccc1)OCC1CC1.
What is the InChIKey of cyclopropylmethyl 2-benzhydryloxyacetate?
The InChIKey is UTJMJDXLLTXAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O3/c20-18(21-13-15-11-12-15)14-22-19(16-7-3-1-4-8-16)17-9-5-2-6-10-17/h1-10,15,19H,11-14H2.
What are the key properties of cyclopropylmethyl 2-benzhydryloxyacetate?
cyclopropylmethyl 2-benzhydryloxyacetate has a molecular weight of 296.37 g/mol, XLogP of 3.75, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropylmethyl 2-benzhydryloxyacetate is sourced from PubChem (CID 57147359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).