1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide

C20H24N2O2 — CID 23732565

IUPAC1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide
SMILESCCCOc1ccc(C2(C(=O)Nc3ccncc3)CCCC2)cc1
InChIInChI=1S/C20H24N2O2/c1-2-15-24-18-7-5-16(6-8-18)20(11-3-4-12-20)19(23)22-17-9-13-21-14-10-17/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,21,22,23)
InChIKeyVMPFKSKKKGRGNC-UHFFFAOYSA-N
MW324.42 g/mol
LogP4.32
Rot. Bonds6

About 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide

1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide (PubChem CID 23732565) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide
PubChem CID23732565
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC Name1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide
SMILESCCCOc1ccc(C2(C(=O)Nc3ccncc3)CCCC2)cc1
InChIInChI=1S/C20H24N2O2/c1-2-15-24-18-7-5-16(6-8-18)20(11-3-4-12-20)19(23)22-17-9-13-21-14-10-17/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,21,22,23)
InChIKeyVMPFKSKKKGRGNC-UHFFFAOYSA-N
XLogP4.32
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-N-(4-propoxyphenyl)cyclobutane-1-carboxamide
CID 110439215
N-(4-butoxyphenyl)-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 100668241
4-(4-methoxyphenyl)-N-(4-propoxyphenyl)oxane-4-carboxamide
CID 100686962
N-(2-hydroxyethyl)-1-(4-propoxyphenyl)cyclopentane-1-carboxamide
CID 56692662
N-(4-ethoxyphenyl)-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 94829289
N-[4-[3-(diethylamino)propoxy]phenyl]-1-phenylcyclopentane-1-carboxamide
CID 100658332
N-[4-(2-ethoxyethoxy)phenyl]-1-(4-nitrophenyl)cyclopentane-1-carboxamide
CID 100659626
2-[4-[[1-(4-methoxyphenyl)cyclopentanecarbonyl]amino]phenoxy]acetic acid
CID 100668327
N-[4-[3-(dimethylamino)propoxy]phenyl]-1-phenylcyclopentane-1-carboxamide
CID 100658314
N-(4-butoxyphenyl)-4-(4-methoxyphenyl)oxane-4-carboxamide
CID 100686987
N-[4-[3-(dimethylamino)propoxy]phenyl]-1-(4-fluorophenyl)cyclohexane-1-carboxamide
CID 100674265
1-(4-chlorophenyl)-N-(3-chloro-4-propoxyphenyl)cyclohexane-1-carboxamide
CID 100675916

Frequently Asked Questions

What is the IUPAC name of 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide?
The IUPAC name of 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide (CID 23732565) is 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide.
What is the SMILES notation for 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide?
The canonical SMILES for 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide is CCCOc1ccc(C2(C(=O)Nc3ccncc3)CCCC2)cc1.
What is the InChIKey of 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide?
The InChIKey is VMPFKSKKKGRGNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-2-15-24-18-7-5-16(6-8-18)20(11-3-4-12-20)19(23)22-17-9-13-21-14-10-17/h5-10,13-14H,2-4,11-12,15H2,1H3,(H,21,22,23).
What are the key properties of 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide?
1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide has a molecular weight of 324.42 g/mol, XLogP of 4.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propoxyphenyl)-N-pyridin-4-ylcyclopentane-1-carboxamide is sourced from PubChem (CID 23732565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).