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

C18H28N2O2 — CID 71851177

IUPACN-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide
SMILESCC(C)CC(CNC(=O)C1=CCCC1)NC(=O)C1=CCCC1
InChIInChI=1S/C18H28N2O2/c1-13(2)11-16(20-18(22)15-9-5-6-10-15)12-19-17(21)14-7-3-4-8-14/h7,9,13,16H,3-6,8,10-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyDSCIBROGSHABFF-UHFFFAOYSA-N
MW304.43 g/mol
LogP2.85
Rot. Bonds7

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

N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide (PubChem CID 71851177) has the molecular formula C18H28N2O2 and a molecular weight of 304.43 g/mol. Its IUPAC name is N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide.

Molecular Properties

Compound NameN-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide
PubChem CID71851177
Molecular FormulaC18H28N2O2
Molecular Weight304.43 g/mol
Exact Mass304.22
IUPAC NameN-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide
SMILESCC(C)CC(CNC(=O)C1=CCCC1)NC(=O)C1=CCCC1
InChIInChI=1S/C18H28N2O2/c1-13(2)11-16(20-18(22)15-9-5-6-10-15)12-19-17(21)14-7-3-4-8-14/h7,9,13,16H,3-6,8,10-12H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyDSCIBROGSHABFF-UHFFFAOYSA-N
XLogP2.85
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.43
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide?
The IUPAC name of N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide (CID 71851177) is N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide.
What is the SMILES notation for N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide?
The canonical SMILES for N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide is CC(C)CC(CNC(=O)C1=CCCC1)NC(=O)C1=CCCC1.
What is the InChIKey of N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide?
The InChIKey is DSCIBROGSHABFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O2/c1-13(2)11-16(20-18(22)15-9-5-6-10-15)12-19-17(21)14-7-3-4-8-14/h7,9,13,16H,3-6,8,10-12H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide?
N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide has a molecular weight of 304.43 g/mol, XLogP of 2.85, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(cyclopentene-1-carbonylamino)-4-methylpentyl]cyclopentene-1-carboxamide is sourced from PubChem (CID 71851177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).