2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide

C21H33NO4 — CID 12888743

IUPAC2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)COCC1CCC(COCc2ccccc2)O1
InChIInChI=1S/C21H33NO4/c1-3-12-22(13-4-2)21(23)17-25-16-20-11-10-19(26-20)15-24-14-18-8-6-5-7-9-18/h5-9,19-20H,3-4,10-17H2,1-2H3
InChIKeyWLPYCEWIALNXKS-UHFFFAOYSA-N
MW363.50 g/mol
LogP3.42
Rot. Bonds12

About 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide

2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide (PubChem CID 12888743) has the molecular formula C21H33NO4 and a molecular weight of 363.50 g/mol. Its IUPAC name is 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide
PubChem CID12888743
Molecular FormulaC21H33NO4
Molecular Weight363.50 g/mol
Exact Mass363.24
IUPAC Name2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)COCC1CCC(COCc2ccccc2)O1
InChIInChI=1S/C21H33NO4/c1-3-12-22(13-4-2)21(23)17-25-16-20-11-10-19(26-20)15-24-14-18-8-6-5-7-9-18/h5-9,19-20H,3-4,10-17H2,1-2H3
InChIKeyWLPYCEWIALNXKS-UHFFFAOYSA-N
XLogP3.42
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.50
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methyl 2-[5-(phenylmethoxymethyl)oxolan-2-yl]acetate
CID 72501445
(6S)-2-ethyl-6-(phenylmethoxymethyl)oxane
CID 139257658
trimethyl-[[(2R,5S)-5-(phenylmethoxymethyl)oxolan-2-yl]methyl]silane
CID 100983477
[(2S,5S)-5-(2-phenylmethoxyethoxymethyl)oxolan-2-yl]methyl acetate
CID 125485988
N-benzyl-2-ethoxy-N-propylacetamide
CID 60655890
butyl 2-[(2R,6S)-6-(phenylmethoxymethyl)oxan-2-yl]acetate
CID 102144353
2-bromo-1-[5-(phenylmethoxymethyl)oxolan-2-yl]ethanone
CID 155043251
2-[cyclopropylmethyl-(2-phenylmethoxyacetyl)amino]acetic acid
CID 43655474
N-[(1-methylpyrrol-2-yl)methyl]-2-phenylmethoxy-N-propylacetamide
CID 7237066
[(2R,6S)-6-(phenylmethoxymethyl)-1,4-dioxan-2-yl]methyl acetate
CID 93493280
(1R)-1-[(2R,5R)-5-(phenylmethoxymethyl)oxolan-2-yl]undecan-1-ol
CID 11545059
N-benzyl-N-(furan-2-ylmethyl)-2-[(2-phenylmethoxyacetyl)-propylamino]acetamide
CID 42773035

Frequently Asked Questions

What is the IUPAC name of 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide?
The IUPAC name of 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide (CID 12888743) is 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide?
The canonical SMILES for 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide is CCCN(CCC)C(=O)COCC1CCC(COCc2ccccc2)O1.
What is the InChIKey of 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide?
The InChIKey is WLPYCEWIALNXKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33NO4/c1-3-12-22(13-4-2)21(23)17-25-16-20-11-10-19(26-20)15-24-14-18-8-6-5-7-9-18/h5-9,19-20H,3-4,10-17H2,1-2H3.
What are the key properties of 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide?
2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide has a molecular weight of 363.50 g/mol, XLogP of 3.42, 12 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[5-(phenylmethoxymethyl)oxolan-2-yl]methoxy]-N,N-dipropylacetamide is sourced from PubChem (CID 12888743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).