4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide

C19H27NO3 — CID 109399951

IUPAC4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide
SMILESCN(CC1CCCC1O)C(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C19H27NO3/c1-20(13-15-5-4-8-18(15)21)19(22)14-9-11-17(12-10-14)23-16-6-2-3-7-16/h9-12,15-16,18,21H,2-8,13H2,1H3
InChIKeyVBEVZFSFMZBNDJ-UHFFFAOYSA-N
MW317.43 g/mol
LogP3.24
Rot. Bonds5

About 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide

4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide (PubChem CID 109399951) has the molecular formula C19H27NO3 and a molecular weight of 317.43 g/mol. Its IUPAC name is 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide
PubChem CID109399951
Molecular FormulaC19H27NO3
Molecular Weight317.43 g/mol
Exact Mass317.20
IUPAC Name4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide
SMILESCN(CC1CCCC1O)C(=O)c1ccc(OC2CCCC2)cc1
InChIInChI=1S/C19H27NO3/c1-20(13-15-5-4-8-18(15)21)19(22)14-9-11-17(12-10-14)23-16-6-2-3-7-16/h9-12,15-16,18,21H,2-8,13H2,1H3
InChIKeyVBEVZFSFMZBNDJ-UHFFFAOYSA-N
XLogP3.24
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2-hydroxycyclohexyl)methyl]-4-[(E)-methoxyiminomethyl]-N-methylbenzamide
CID 110003396
N-[(2-hydroxycyclopentyl)methyl]-N-methyl-4-(2-oxopyrrolidin-1-yl)benzamide
CID 109400327
4-(4-ethylpiperazin-1-yl)-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide
CID 109400509
2-bromo-N-[(2-hydroxycyclopentyl)methyl]-4-methoxy-N-methylbenzamide
CID 109399821
6-(cyclopropylmethoxy)-N-[(2-hydroxycyclopentyl)methyl]-N-methylpyridine-3-carboxamide
CID 109400138
N-[(2-hydroxycyclohexyl)methyl]-N-methyl-4-(4-methyl-1,3-thiazol-2-yl)benzamide
CID 110003457
N-[4-[(2-hydroxycyclopentyl)methyl-methylcarbamoyl]phenyl]furan-2-carboxamide
CID 109400174
3-N-[(2-hydroxycyclohexyl)methyl]-1-N,3-N-dimethylbenzene-1,3-dicarboxamide
CID 110003462
N-[(2-hydroxycyclopentyl)methyl]-N,4-dimethyl-3-nitrobenzamide
CID 109399669
N-[(2-hydroxycyclohexyl)methyl]-N,3-dimethyl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
CID 110003398
4-cycloheptyloxybenzamide
CID 141109251
N-[(2-hydroxycyclopentyl)methyl]-6-methoxy-N-methylquinoline-2-carboxamide
CID 109399670

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide?
The IUPAC name of 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide (CID 109399951) is 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide.
What is the SMILES notation for 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide?
The canonical SMILES for 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide is CN(CC1CCCC1O)C(=O)c1ccc(OC2CCCC2)cc1.
What is the InChIKey of 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide?
The InChIKey is VBEVZFSFMZBNDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27NO3/c1-20(13-15-5-4-8-18(15)21)19(22)14-9-11-17(12-10-14)23-16-6-2-3-7-16/h9-12,15-16,18,21H,2-8,13H2,1H3.
What are the key properties of 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide?
4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide has a molecular weight of 317.43 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyloxy-N-[(2-hydroxycyclopentyl)methyl]-N-methylbenzamide is sourced from PubChem (CID 109399951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).