4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide

C17H26N2O2 — CID 134492462

IUPAC4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide
SMILESCNC(=O)C1=CCC(CC(C)NC(=O)C2=CCCC2)CC1
InChIInChI=1S/C17H26N2O2/c1-12(19-17(21)14-5-3-4-6-14)11-13-7-9-15(10-8-13)16(20)18-2/h5,9,12-13H,3-4,6-8,10-11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyUHJYCQVMKRKSIV-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.46
Rot. Bonds5

About 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide

4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide (PubChem CID 134492462) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide.

Molecular Properties

Compound Name4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide
PubChem CID134492462
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide
SMILESCNC(=O)C1=CCC(CC(C)NC(=O)C2=CCCC2)CC1
InChIInChI=1S/C17H26N2O2/c1-12(19-17(21)14-5-3-4-6-14)11-13-7-9-15(10-8-13)16(20)18-2/h5,9,12-13H,3-4,6-8,10-11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyUHJYCQVMKRKSIV-UHFFFAOYSA-N
XLogP2.46
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide?
The IUPAC name of 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide (CID 134492462) is 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide.
What is the SMILES notation for 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide?
The canonical SMILES for 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide is CNC(=O)C1=CCC(CC(C)NC(=O)C2=CCCC2)CC1.
What is the InChIKey of 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide?
The InChIKey is UHJYCQVMKRKSIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12(19-17(21)14-5-3-4-6-14)11-13-7-9-15(10-8-13)16(20)18-2/h5,9,12-13H,3-4,6-8,10-11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide?
4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide has a molecular weight of 290.41 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(cyclopentene-1-carbonylamino)propyl]-N-methylcyclohexene-1-carboxamide is sourced from PubChem (CID 134492462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).