4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide

C23H29NO4 — CID 55833317

IUPAC4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
SMILESCCOc1ccc(CN(C)C(=O)c2ccc(OC3CCCC3)c(OC)c2)cc1
InChIInChI=1S/C23H29NO4/c1-4-27-19-12-9-17(10-13-19)16-24(2)23(25)18-11-14-21(22(15-18)26-3)28-20-7-5-6-8-20/h9-15,20H,4-8,16H2,1-3H3
InChIKeyCKBDYKDEMBQNIT-UHFFFAOYSA-N
MW383.49 g/mol
LogP4.69
Rot. Bonds8

About 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide

4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide (PubChem CID 55833317) has the molecular formula C23H29NO4 and a molecular weight of 383.49 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
PubChem CID55833317
Molecular FormulaC23H29NO4
Molecular Weight383.49 g/mol
Exact Mass383.21
IUPAC Name4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
SMILESCCOc1ccc(CN(C)C(=O)c2ccc(OC3CCCC3)c(OC)c2)cc1
InChIInChI=1S/C23H29NO4/c1-4-27-19-12-9-17(10-13-19)16-24(2)23(25)18-11-14-21(22(15-18)26-3)28-20-7-5-6-8-20/h9-15,20H,4-8,16H2,1-3H3
InChIKeyCKBDYKDEMBQNIT-UHFFFAOYSA-N
XLogP4.69
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.49
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-cyclopentyloxy-3-methoxy-N-methyl-N-(2-oxopropyl)benzamide
CID 130184757
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-3-ethoxy-4-methoxy-N-methylbenzamide
CID 38394612
4-ethoxy-3-methoxy-N-methyl-N-[(4-methylsulfanylphenyl)methyl]benzamide
CID 78771375
3-bromo-4-ethoxy-N-[(4-ethoxyphenyl)methyl]-5-methoxy-N-methylbenzamide
CID 34865376
3-ethoxy-4-methoxy-N-[(6-methoxynaphthalen-2-yl)methyl]-N-methylbenzamide
CID 43012781
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide
CID 27822856
N-[(4-chlorophenyl)methyl]-3,4-dimethoxy-N-methylbenzamide
CID 28632210
N-[(4-ethoxyphenyl)methyl]-N-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 34865342
N-[(4-ethoxyphenyl)methyl]-N,4-dimethylbenzamide
CID 78780692
4-(1-cyclopentylpiperidin-4-yl)oxy-3-methoxy-N-(2-methoxyethyl)-N-methylbenzamide
CID 25491681
3-[(4-cyclopentyloxy-3-methoxybenzoyl)-ethylamino]propanoic acid
CID 119191501
4-ethoxy-N-[(4-fluorophenyl)methyl]-N-methylbenzamide
CID 78770402

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide?
The IUPAC name of 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide (CID 55833317) is 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide?
The canonical SMILES for 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide is CCOc1ccc(CN(C)C(=O)c2ccc(OC3CCCC3)c(OC)c2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide?
The InChIKey is CKBDYKDEMBQNIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H29NO4/c1-4-27-19-12-9-17(10-13-19)16-24(2)23(25)18-11-14-21(22(15-18)26-3)28-20-7-5-6-8-20/h9-15,20H,4-8,16H2,1-3H3.
What are the key properties of 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide?
4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide has a molecular weight of 383.49 g/mol, XLogP of 4.69, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-[(4-ethoxyphenyl)methyl]-3-methoxy-N-methylbenzamide is sourced from PubChem (CID 55833317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).