N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

C16H21NO2 — CID 110485718

IUPACN-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)NC3CCCC3)CC2)cc1
InChIInChI=1S/C16H21NO2/c1-19-14-8-6-12(7-9-14)16(10-11-16)15(18)17-13-4-2-3-5-13/h6-9,13H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyXWUKBFLDBPCKNL-UHFFFAOYSA-N
MW259.35 g/mol
LogP2.79
Rot. Bonds4

About N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide

N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 110485718) has the molecular formula C16H21NO2 and a molecular weight of 259.35 g/mol. Its IUPAC name is N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
PubChem CID110485718
Molecular FormulaC16H21NO2
Molecular Weight259.35 g/mol
Exact Mass259.16
IUPAC NameN-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
SMILESCOc1ccc(C2(C(=O)NC3CCCC3)CC2)cc1
InChIInChI=1S/C16H21NO2/c1-19-14-8-6-12(7-9-14)16(10-11-16)15(18)17-13-4-2-3-5-13/h6-9,13H,2-5,10-11H2,1H3,(H,17,18)
InChIKeyXWUKBFLDBPCKNL-UHFFFAOYSA-N
XLogP2.79
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.35
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cycloheptyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide
CID 113198451
1-(4-methoxyphenyl)-N-methylcyclopropane-1-carboxamide
CID 53016794
1-(4-methoxyphenyl)-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]cyclopropane-1-carboxamide
CID 95713073
N-[(1R,2S)-2-aminocyclobutyl]-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 133128043
1-(4-acetamidophenyl)-N-cyclopentylcyclobutane-1-carboxamide
CID 53110546
1-(4-methoxyphenyl)-N'-methylcyclopropane-1-carbohydrazide
CID 116847276
1-cyclopentyl-3-[[1-(4-methoxyphenyl)cyclopropyl]methyl]urea
CID 113214574
N-cyclopentyl-1-[4-[(4-ethoxyphenyl)sulfonylamino]phenyl]cyclopropane-1-carboxamide
CID 50822210
1-(4-acetamidophenyl)-N-cycloheptylcyclohexane-1-carboxamide
CID 53110342
N-(1,1-dioxothian-4-yl)-1-(4-propan-2-yloxyphenyl)cyclopentane-1-carboxamide
CID 119063443
N-[1-(4-methoxyphenyl)sulfonylpiperidin-4-yl]-1-phenylcyclobutane-1-carboxamide
CID 24668842
1-cyclohexyl-3-[(4-methoxyphenyl)methyl]urea
CID 854988

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide (CID 110485718) is N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide is COc1ccc(C2(C(=O)NC3CCCC3)CC2)cc1.
What is the InChIKey of N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is XWUKBFLDBPCKNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO2/c1-19-14-8-6-12(7-9-14)16(10-11-16)15(18)17-13-4-2-3-5-13/h6-9,13H,2-5,10-11H2,1H3,(H,17,18).
What are the key properties of N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide?
N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 259.35 g/mol, XLogP of 2.79, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-1-(4-methoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 110485718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).