N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide

C15H20ClNO2 — CID 2668973

IUPACN-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)CC1CCCC1
InChIInChI=1S/C15H20ClNO2/c1-10-7-13(14(19-2)9-12(10)16)17-15(18)8-11-5-3-4-6-11/h7,9,11H,3-6,8H2,1-2H3,(H,17,18)
InChIKeyYMECKOMVZQQMDU-UHFFFAOYSA-N
MW281.78 g/mol
LogP4.18
Rot. Bonds4

About N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide

N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide (PubChem CID 2668973) has the molecular formula C15H20ClNO2 and a molecular weight of 281.78 g/mol. Its IUPAC name is N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide.

Molecular Properties

Compound NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide
PubChem CID2668973
Molecular FormulaC15H20ClNO2
Molecular Weight281.78 g/mol
Exact Mass281.12
IUPAC NameN-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide
SMILESCOc1cc(Cl)c(C)cc1NC(=O)CC1CCCC1
InChIInChI=1S/C15H20ClNO2/c1-10-7-13(14(19-2)9-12(10)16)17-15(18)8-11-5-3-4-6-11/h7,9,11H,3-6,8H2,1-2H3,(H,17,18)
InChIKeyYMECKOMVZQQMDU-UHFFFAOYSA-N
XLogP4.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.78
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-chlorophenyl)-3-(4-methoxyphenyl)propanamide
CID 2666115
N-(5-Chloro-2-methoxyphenyl)-3-(4-methoxyphenyl)propanamide
CID 868614
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(3,4-dimethoxyphenyl)acetamide
CID 975319
N-(5-chloro-2-methoxyphenyl)-3-phenylpropanamide
CID 1040166
butyl N-(4-chloro-2-methoxy-5-methylphenyl)carbamate
CID 1568291
[2-(4-Chloro-2-methoxy-5-methylanilino)-2-oxoethyl] 2,3-dihydro-1,4-dioxine-5-carboxylate
CID 2584010
N-(5-chloro-2-methoxyphenyl)-3-phenylbutanamide
CID 2916459
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)acetamide
CID 4826976
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)acetamide
CID 2335619
2-cyclopentyl-N-(2-methoxyphenyl)acetamide
CID 2599428
[2-(4-Chloro-2-methoxy-5-methylanilino)-2-oxoethyl] 2-methylcyclopropane-1-carboxylate
CID 3419297
N-(4-chloro-2-methoxy-5-methylphenyl)-2-(1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl)acetamide
CID 5234733

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide?
The IUPAC name of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide (CID 2668973) is N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide.
What is the SMILES notation for N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide?
The canonical SMILES for N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide is COc1cc(Cl)c(C)cc1NC(=O)CC1CCCC1.
What is the InChIKey of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide?
The InChIKey is YMECKOMVZQQMDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO2/c1-10-7-13(14(19-2)9-12(10)16)17-15(18)8-11-5-3-4-6-11/h7,9,11H,3-6,8H2,1-2H3,(H,17,18).
What are the key properties of N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide?
N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide has a molecular weight of 281.78 g/mol, XLogP of 4.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-2-methoxy-5-methylphenyl)-2-cyclopentylacetamide is sourced from PubChem (CID 2668973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).