1-(4-phenoxyphenyl)cyclopropane-1-carboxamide

C16H15NO2 — CID 174895931

IUPAC1-(4-phenoxyphenyl)cyclopropane-1-carboxamide
SMILESNC(=O)C1(c2ccc(Oc3ccccc3)cc2)CC1
InChIInChI=1S/C16H15NO2/c17-15(18)16(10-11-16)12-6-8-14(9-7-12)19-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,17,18)
InChIKeyBHCCNNPSYCKYCN-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.00
Rot. Bonds4

About 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide

1-(4-phenoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 174895931) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-phenoxyphenyl)cyclopropane-1-carboxamide
PubChem CID174895931
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name1-(4-phenoxyphenyl)cyclopropane-1-carboxamide
SMILESNC(=O)C1(c2ccc(Oc3ccccc3)cc2)CC1
InChIInChI=1S/C16H15NO2/c17-15(18)16(10-11-16)12-6-8-14(9-7-12)19-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,17,18)
InChIKeyBHCCNNPSYCKYCN-UHFFFAOYSA-N
XLogP3.00
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenylcyclopropane-1-carboxamide;hydrochloride
CID 57461944
1-phenylcyclopentane-1-carboxamide;dihydrochloride
CID 142770378
ethane;1-(4-hydroxyphenyl)cyclopropane-1-carboxamide
CID 143988674
N-deuterio-1-phenylcyclopropane-1-carboxamide
CID 175986247
4-carbamoyl-4-phenylcyclohexane-1-carboxylic acid
CID 115046067
1-[4-(1-methylpyrazol-4-yl)oxyphenyl]cyclopropane-1-carboxylic acid
CID 172554828
1-[4-(pentafluoro-λ6-sulfanyl)phenyl]cyclopropane-1-carboxamide
CID 156893243
1-(4-methoxyphenyl)cyclobutan-1-amine;1-(4-methoxyphenyl)cyclobutane-1-carboxamide;hydrochloride
CID 158410328
2-(4-carbamoyl-4-phenylcyclohexyl)acetic acid
CID 115048821
1-[4-(dideuteriomethoxy)phenyl]cyclopropane-1-carboxylic acid
CID 88598145
1-(4-aminophenyl)cyclopropane-1-carboxylic acid;hydrochloride
CID 155970614
1-[4-(2-hydroxyethoxy)phenyl]cyclopropane-1-carboxylic acid
CID 117317655

Frequently Asked Questions

What is the IUPAC name of 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide (CID 174895931) is 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide is NC(=O)C1(c2ccc(Oc3ccccc3)cc2)CC1.
What is the InChIKey of 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is BHCCNNPSYCKYCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c17-15(18)16(10-11-16)12-6-8-14(9-7-12)19-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,17,18).
What are the key properties of 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide?
1-(4-phenoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 253.30 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-phenoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 174895931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).