N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide

C22H24N2O3 — CID 46585132

IUPACN-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide
SMILESO=C(Nc1ccc(OC2CCCC2)cc1)c1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C22H24N2O3/c25-21(15-8-9-15)24-18-5-3-4-16(14-18)22(26)23-17-10-12-20(13-11-17)27-19-6-1-2-7-19/h3-5,10-15,19H,1-2,6-9H2,(H,23,26)(H,24,25)
InChIKeyLVEUJYKNFKPVNF-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.61
Rot. Bonds6

About N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide

N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide (PubChem CID 46585132) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide.

Molecular Properties

Compound NameN-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide
PubChem CID46585132
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide
SMILESO=C(Nc1ccc(OC2CCCC2)cc1)c1cccc(NC(=O)C2CC2)c1
InChIInChI=1S/C22H24N2O3/c25-21(15-8-9-15)24-18-5-3-4-16(14-18)22(26)23-17-10-12-20(13-11-17)27-19-6-1-2-7-19/h3-5,10-15,19H,1-2,6-9H2,(H,23,26)(H,24,25)
InChIKeyLVEUJYKNFKPVNF-UHFFFAOYSA-N
XLogP4.61
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide?
The IUPAC name of N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide (CID 46585132) is N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide.
What is the SMILES notation for N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide?
The canonical SMILES for N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide is O=C(Nc1ccc(OC2CCCC2)cc1)c1cccc(NC(=O)C2CC2)c1.
What is the InChIKey of N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide?
The InChIKey is LVEUJYKNFKPVNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c25-21(15-8-9-15)24-18-5-3-4-16(14-18)22(26)23-17-10-12-20(13-11-17)27-19-6-1-2-7-19/h3-5,10-15,19H,1-2,6-9H2,(H,23,26)(H,24,25).
What are the key properties of N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide?
N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide has a molecular weight of 364.45 g/mol, XLogP of 4.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxyphenyl)-3-(cyclopropanecarbonylamino)benzamide is sourced from PubChem (CID 46585132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).