N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide

C18H24N2O2 — CID 837694

IUPACN-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
SMILESO=C(Nc1ccccc1NC(=O)C1CCCC1)C1CCCC1
InChIInChI=1S/C18H24N2O2/c21-17(13-7-1-2-8-13)19-15-11-5-6-12-16(15)20-18(22)14-9-3-4-10-14/h5-6,11-14H,1-4,7-10H2,(H,19,21)(H,20,22)
InChIKeyRTIKOUBVJTZHDV-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.94
Rot. Bonds4

About N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide

N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide (PubChem CID 837694) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
PubChem CID837694
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide
SMILESO=C(Nc1ccccc1NC(=O)C1CCCC1)C1CCCC1
InChIInChI=1S/C18H24N2O2/c21-17(13-7-1-2-8-13)19-15-11-5-6-12-16(15)20-18(22)14-9-3-4-10-14/h5-6,11-14H,1-4,7-10H2,(H,19,21)(H,20,22)
InChIKeyRTIKOUBVJTZHDV-UHFFFAOYSA-N
XLogP3.94
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide?
The IUPAC name of N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide (CID 837694) is N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide?
The canonical SMILES for N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide is O=C(Nc1ccccc1NC(=O)C1CCCC1)C1CCCC1.
What is the InChIKey of N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide?
The InChIKey is RTIKOUBVJTZHDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c21-17(13-7-1-2-8-13)19-15-11-5-6-12-16(15)20-18(22)14-9-3-4-10-14/h5-6,11-14H,1-4,7-10H2,(H,19,21)(H,20,22).
What are the key properties of N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide?
N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide has a molecular weight of 300.40 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopentanecarbonylamino)phenyl]cyclopentanecarboxamide is sourced from PubChem (CID 837694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).