1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide

C23H20ClNO2 — CID 2525284

IUPAC1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)C1(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C23H20ClNO2/c24-19-8-6-18(7-9-19)23(14-15-23)22(26)25-20-10-12-21(13-11-20)27-16-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,25,26)
InChIKeyPEBMPAPEWWIEBR-UHFFFAOYSA-N
MW377.87 g/mol
LogP5.59
Rot. Bonds6

About 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide

1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide (PubChem CID 2525284) has the molecular formula C23H20ClNO2 and a molecular weight of 377.87 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide.

Molecular Properties

Compound Name1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
PubChem CID2525284
Molecular FormulaC23H20ClNO2
Molecular Weight377.87 g/mol
Exact Mass377.12
IUPAC Name1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
SMILESO=C(Nc1ccc(OCc2ccccc2)cc1)C1(c2ccc(Cl)cc2)CC1
InChIInChI=1S/C23H20ClNO2/c24-19-8-6-18(7-9-19)23(14-15-23)22(26)25-20-10-12-21(13-11-20)27-16-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,25,26)
InChIKeyPEBMPAPEWWIEBR-UHFFFAOYSA-N
XLogP5.59
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500377.87
LogP ≤ 55.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-methoxyphenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide
CID 113198528
4-(4-methylphenyl)-N-(4-phenylmethoxyphenyl)oxane-4-carboxamide
CID 100681565
2-[4-[[1-(4-chlorophenyl)cyclopentanecarbonyl]amino]phenoxy]acetic acid
CID 100665395
3-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)propanamide
CID 19220831
1-(4-chlorophenyl)-N-phenylcyclopentane-1-carboxamide
CID 22236982
4-[4-(2-methylpyrimidin-5-yl)phenyl]-N-(4-phenylmethoxyphenyl)oxane-4-carboxamide
CID 67987918
1-[1-(4-phenylmethoxyphenyl)cyclopropyl]ethanone
CID 59016188
4-(4-chlorophenyl)-4-oxo-N-(4-phenylmethoxyphenyl)butanamide
CID 2400388
4-(2-fluorophenyl)-N-(4-phenylmethoxyphenyl)oxane-4-carboxamide
CID 100682380
1-(4-chlorophenyl)-N-[4-[(1-methylimidazol-2-yl)methoxy]phenyl]cyclobutane-1-carboxamide
CID 55882122
1-(4-aminophenyl)-N-(4-chlorophenyl)cyclopropane-1-carboxamide
CID 99706799
4-(4-chlorophenyl)-N-(4-prop-2-enoxyphenyl)oxane-4-carboxamide
CID 100781339

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide?
The IUPAC name of 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide (CID 2525284) is 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide.
What is the SMILES notation for 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide?
The canonical SMILES for 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide is O=C(Nc1ccc(OCc2ccccc2)cc1)C1(c2ccc(Cl)cc2)CC1.
What is the InChIKey of 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide?
The InChIKey is PEBMPAPEWWIEBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClNO2/c24-19-8-6-18(7-9-19)23(14-15-23)22(26)25-20-10-12-21(13-11-20)27-16-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,25,26).
What are the key properties of 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide?
1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide has a molecular weight of 377.87 g/mol, XLogP of 5.59, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-N-(4-phenylmethoxyphenyl)cyclopropane-1-carboxamide is sourced from PubChem (CID 2525284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).