[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone

C15H25NO — CID 106655460

IUPAC[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone
SMILESNCC1CCCC1C(=O)C1=CCCCCCC1
InChIInChI=1S/C15H25NO/c16-11-13-9-6-10-14(13)15(17)12-7-4-2-1-3-5-8-12/h7,13-14H,1-6,8-11,16H2
InChIKeyGLCNCKKGSSXMHB-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.21
Rot. Bonds3

About [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone

[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone (PubChem CID 106655460) has the molecular formula C15H25NO and a molecular weight of 235.37 g/mol. Its IUPAC name is [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone.

Molecular Properties

Compound Name[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone
PubChem CID106655460
Molecular FormulaC15H25NO
Molecular Weight235.37 g/mol
Exact Mass235.19
IUPAC Name[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone
SMILESNCC1CCCC1C(=O)C1=CCCCCCC1
InChIInChI=1S/C15H25NO/c16-11-13-9-6-10-14(13)15(17)12-7-4-2-1-3-5-8-12/h7,13-14H,1-6,8-11,16H2
InChIKeyGLCNCKKGSSXMHB-UHFFFAOYSA-N
XLogP3.21
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexen-1-yl-(2-ethylcyclohexyl)methanone
CID 103450041
cyclohexen-1-yl-(2-methylcyclopentyl)methanone
CID 107176498
cycloheptene-1-carboxamide
CID 22261654
3-amino-1-(cyclohepten-1-yl)propan-1-one
CID 106655124
2-cyclohexyl-1-(cycloocten-1-yl)ethanone
CID 106655870
cycloocten-1-yl-(2,2,3,3-tetramethylcyclopropyl)methanone
CID 106655849
ethyl cycloundecene-1-carboxylate
CID 154164177
cyclohepten-1-yl-(3-methylcyclohexyl)methanone
CID 103450394
azetidin-3-yl(cycloocten-1-yl)methanone
CID 106655454
7-azabicyclo[2.2.1]heptan-2-yl(cyclohexen-1-yl)methanone
CID 106655380
cycloocten-1-yl(thiolan-2-yl)methanone
CID 106652102
1-[(1E)-cycloocten-1-yl]-2-(4-methylphenyl)ethanone
CID 106651792

Frequently Asked Questions

What is the IUPAC name of [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone?
The IUPAC name of [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone (CID 106655460) is [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone.
What is the SMILES notation for [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone?
The canonical SMILES for [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone is NCC1CCCC1C(=O)C1=CCCCCCC1.
What is the InChIKey of [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone?
The InChIKey is GLCNCKKGSSXMHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO/c16-11-13-9-6-10-14(13)15(17)12-7-4-2-1-3-5-8-12/h7,13-14H,1-6,8-11,16H2.
What are the key properties of [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone?
[2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone has a molecular weight of 235.37 g/mol, XLogP of 3.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(aminomethyl)cyclopentyl]-(cycloocten-1-yl)methanone is sourced from PubChem (CID 106655460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).