N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide

C19H27NO4 — CID 45239699

IUPACN-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide
SMILESCOCC(=O)N(Cc1ccc(OC2CCOC2)cc1)C1CCCC1
InChIInChI=1S/C19H27NO4/c1-22-14-19(21)20(16-4-2-3-5-16)12-15-6-8-17(9-7-15)24-18-10-11-23-13-18/h6-9,16,18H,2-5,10-14H2,1H3
InChIKeyMSWIMLCCCULHRY-UHFFFAOYSA-N
MW333.43 g/mol
LogP2.77
Rot. Bonds7

About N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide

N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide (PubChem CID 45239699) has the molecular formula C19H27NO4 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide
PubChem CID45239699
Molecular FormulaC19H27NO4
Molecular Weight333.43 g/mol
Exact Mass333.19
IUPAC NameN-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide
SMILESCOCC(=O)N(Cc1ccc(OC2CCOC2)cc1)C1CCCC1
InChIInChI=1S/C19H27NO4/c1-22-14-19(21)20(16-4-2-3-5-16)12-15-6-8-17(9-7-15)24-18-10-11-23-13-18/h6-9,16,18H,2-5,10-14H2,1H3
InChIKeyMSWIMLCCCULHRY-UHFFFAOYSA-N
XLogP2.77
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 52.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-(2-methyl-1,3-thiazol-4-yl)-N-[[4-[(3R)-oxolan-3-yl]oxyphenyl]methyl]acetamide
CID 42191123
N-cyclopentyl-N-[[4-(oxolan-3-yloxy)phenyl]methyl]-3-phenyl-1H-pyrazole-5-carboxamide
CID 45195424
N-[[4-(2,3-dihydro-1H-inden-2-yloxy)phenyl]methyl]-2-methoxy-N-[(3S)-2-oxoazepan-3-yl]acetamide
CID 25325962
N-cyclopropyl-N-[(3,4-dichlorophenyl)methyl]-2-methoxyacetamide
CID 61061923
N-[[4-(oxolan-3-yloxy)phenyl]methyl]ethanamine
CID 63557924
1-[4-(oxolan-3-yloxy)phenyl]propan-1-one
CID 63557977
N-cyclohexyl-N-[[4-[[4-(hydroxymethyl)-1,3-thiazol-2-yl]methoxy]phenyl]methyl]-2-methoxyacetamide
CID 42836691
4-[(3R)-oxolan-3-yl]oxybenzoic acid
CID 95979365
4-[4-(oxan-3-yloxy)phenyl]butanoic acid
CID 117415300
(3S)-3-(4-propylphenoxy)oxane
CID 178142370
3-[2-(4-cyclopentyloxyphenyl)ethyl]-1-methyl-1-(oxan-4-yl)urea
CID 84585403
(3R)-3-[4-(2-methylpropyl)phenoxy]oxane
CID 178142322

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide?
The IUPAC name of N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide (CID 45239699) is N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide.
What is the SMILES notation for N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide?
The canonical SMILES for N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide is COCC(=O)N(Cc1ccc(OC2CCOC2)cc1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide?
The InChIKey is MSWIMLCCCULHRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO4/c1-22-14-19(21)20(16-4-2-3-5-16)12-15-6-8-17(9-7-15)24-18-10-11-23-13-18/h6-9,16,18H,2-5,10-14H2,1H3.
What are the key properties of N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide?
N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide has a molecular weight of 333.43 g/mol, XLogP of 2.77, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methoxy-N-[[4-(oxolan-3-yloxy)phenyl]methyl]acetamide is sourced from PubChem (CID 45239699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).