1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide

C21H26N2O3 — CID 90649820

IUPAC1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)NCC(C)Oc3cccnc3)CCCC2)cc1
InChIInChI=1S/C21H26N2O3/c1-16(26-19-6-5-13-22-15-19)14-23-20(24)21(11-3-4-12-21)17-7-9-18(25-2)10-8-17/h5-10,13,15-16H,3-4,11-12,14H2,1-2H3,(H,23,24)
InChIKeyOIWKEKDHAJDAFC-UHFFFAOYSA-N
MW354.45 g/mol
LogP3.49
Rot. Bonds7

About 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide

1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide (PubChem CID 90649820) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide
PubChem CID90649820
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC Name1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)NCC(C)Oc3cccnc3)CCCC2)cc1
InChIInChI=1S/C21H26N2O3/c1-16(26-19-6-5-13-22-15-19)14-23-20(24)21(11-3-4-12-21)17-7-9-18(25-2)10-8-17/h5-10,13,15-16H,3-4,11-12,14H2,1-2H3,(H,23,24)
InChIKeyOIWKEKDHAJDAFC-UHFFFAOYSA-N
XLogP3.49
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chlorophenyl)-N-(2-pyridin-3-yloxypropyl)cyclobutane-1-carboxamide
CID 90649368
3-[[1-(4-methoxyphenyl)cyclopentanecarbonyl]amino]-2-methylpropanoic acid
CID 119237635
N-ethyl-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 110487274
N-[2-(dimethylamino)-2-(4-methoxyphenyl)ethyl]-1-phenylcyclobutane-1-carboxamide
CID 55526819
1-(4-methoxyphenyl)-N-[(2-methylpyrimidin-4-yl)methyl]cyclopentane-1-carboxamide
CID 51099905
1-(4-methoxyphenyl)-N-[(5-pyrazin-2-yl-1,3,4-oxadiazol-2-yl)methyl]cyclopentane-1-carboxamide
CID 92595335
2-ethylsulfanyl-N-[(2R)-2-pyridin-3-yloxypropyl]acetamide
CID 124753809
N-[2-(4-methoxyphenyl)ethyl]-1-phenylcyclopentane-1-carboxamide
CID 4682158
1-(4-methoxyphenyl)-N-methyl-N-(1-pyridin-3-ylethyl)cyclopropane-1-carboxamide
CID 56745365
4-(4-methylpiperazin-1-yl)-N-(2-pyridin-3-yloxypropyl)benzamide
CID 90653299
2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide
CID 90649337
2-amino-6-methyl-N-[(2R)-2-pyridin-3-yloxypropyl]pyrimidine-4-carboxamide
CID 95192547

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide (CID 90649820) is 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide is COc1ccc(C2(C(=O)NCC(C)Oc3cccnc3)CCCC2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide?
The InChIKey is OIWKEKDHAJDAFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c1-16(26-19-6-5-13-22-15-19)14-23-20(24)21(11-3-4-12-21)17-7-9-18(25-2)10-8-17/h5-10,13,15-16H,3-4,11-12,14H2,1-2H3,(H,23,24).
What are the key properties of 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide?
1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide has a molecular weight of 354.45 g/mol, XLogP of 3.49, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-(2-pyridin-3-yloxypropyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 90649820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).