2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide

C14H22N2O2 — CID 71989735

IUPAC2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide
SMILESNC(=O)C1CCCC1NC(=O)CC1=CCCCC1
InChIInChI=1S/C14H22N2O2/c15-14(18)11-7-4-8-12(11)16-13(17)9-10-5-2-1-3-6-10/h5,11-12H,1-4,6-9H2,(H2,15,18)(H,16,17)
InChIKeyMNXGHNIPCKLPEU-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.65
Rot. Bonds4

About 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide

2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide (PubChem CID 71989735) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide
PubChem CID71989735
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide
SMILESNC(=O)C1CCCC1NC(=O)CC1=CCCCC1
InChIInChI=1S/C14H22N2O2/c15-14(18)11-7-4-8-12(11)16-13(17)9-10-5-2-1-3-6-10/h5,11-12H,1-4,6-9H2,(H2,15,18)(H,16,17)
InChIKeyMNXGHNIPCKLPEU-UHFFFAOYSA-N
XLogP1.65
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(2-aminocyclopropyl)-2-(cyclohexen-1-yl)acetamide
CID 63563093
2-(cyclohexen-1-yl)-N-[(3S)-pyrrolidin-3-yl]acetamide
CID 79688799
2-(cyclohexen-1-yl)-N-[(4-hydroxycyclohexyl)methyl]acetamide
CID 106121943
N-(2-aminoethyl)-2-(cyclohexen-1-yl)acetamide
CID 63564998
2-(cyclohexen-1-yl)-N-[2-(cyclopropylamino)ethyl]acetamide
CID 63563665
2-(cyclohexen-1-yl)-N-[(1S,2R)-2-[4-(2-hydroxypropan-2-yl)triazol-1-yl]cyclohexyl]acetamide
CID 128991297
1-(cyclohexen-1-yl)-3-cyclopropylpropan-2-one
CID 116659708
2-[(2-methylsulfonylacetyl)amino]cyclohexane-1-carboxamide
CID 175700374
cis-(1S,2R)-2-[[2-(3-bromo-2-methylphenyl)acetyl]amino]cyclopentane-1-carboxamide
CID 100704809
1-(cyclohexen-1-yl)-3-hydroxypropan-2-one
CID 130030095
2-(4-aminobutanoylamino)cyclohexane-1-carboxamide
CID 119334193
2-(4-bromophenyl)-N-(2-carbamothioylcyclopentyl)acetamide
CID 62955197

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide?
The IUPAC name of 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide (CID 71989735) is 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide?
The canonical SMILES for 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide is NC(=O)C1CCCC1NC(=O)CC1=CCCCC1.
What is the InChIKey of 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide?
The InChIKey is MNXGHNIPCKLPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c15-14(18)11-7-4-8-12(11)16-13(17)9-10-5-2-1-3-6-10/h5,11-12H,1-4,6-9H2,(H2,15,18)(H,16,17).
What are the key properties of 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide?
2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide has a molecular weight of 250.34 g/mol, XLogP of 1.65, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(cyclohexen-1-yl)acetyl]amino]cyclopentane-1-carboxamide is sourced from PubChem (CID 71989735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).