1-(2-aminocyclopentyl)-2-cyclopentylethanone

C12H21NO — CID 116580222

IUPAC1-(2-aminocyclopentyl)-2-cyclopentylethanone
SMILESNC1CCCC1C(=O)CC1CCCC1
InChIInChI=1S/C12H21NO/c13-11-7-3-6-10(11)12(14)8-9-4-1-2-5-9/h9-11H,1-8,13H2
InChIKeyDFQVRCWQNFBKLC-UHFFFAOYSA-N
MW195.31 g/mol
LogP2.26
Rot. Bonds3

About 1-(2-aminocyclopentyl)-2-cyclopentylethanone

1-(2-aminocyclopentyl)-2-cyclopentylethanone (PubChem CID 116580222) has the molecular formula C12H21NO and a molecular weight of 195.31 g/mol. Its IUPAC name is 1-(2-aminocyclopentyl)-2-cyclopentylethanone.

Molecular Properties

Compound Name1-(2-aminocyclopentyl)-2-cyclopentylethanone
PubChem CID116580222
Molecular FormulaC12H21NO
Molecular Weight195.31 g/mol
Exact Mass195.16
IUPAC Name1-(2-aminocyclopentyl)-2-cyclopentylethanone
SMILESNC1CCCC1C(=O)CC1CCCC1
InChIInChI=1S/C12H21NO/c13-11-7-3-6-10(11)12(14)8-9-4-1-2-5-9/h9-11H,1-8,13H2
InChIKeyDFQVRCWQNFBKLC-UHFFFAOYSA-N
XLogP2.26
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.31
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(aminomethyl)cyclopentyl]-2-cyclohexylethanone
CID 116584345
1-[(1S,2R)-2-aminocyclopentyl]butan-1-one
CID 178190862
1-(2-aminocyclopentyl)-2-(2-bicyclo[2.2.1]heptanyl)ethanone
CID 116580084
2-amino-N-(cyclopentylmethyl)cyclopentane-1-carboxamide
CID 64822133
1-[(1S,2R)-2-aminocyclopentyl]but-3-en-1-one
CID 165464901
2-amino-N-(cyclohexylmethyl)cyclopentane-1-carboxamide;hydrochloride
CID 119672519
cyclohexylmethyl 2-aminocyclohexane-1-carboxylate
CID 64817458
cis-(1R,2S)-2-aminocyclohexane-1-carboxylic acid
CID 2724639
1-[2-(aminomethyl)cyclohexyl]-2-(oxan-4-yl)ethanone
CID 116584632
1-[2-(aminomethyl)cyclopentyl]-2-(oxan-4-yl)ethanone
CID 116584347
2-amino-N-(cyclohexylmethyl)-N-methylcyclopentane-1-carboxamide
CID 64822627
1-(2-aminocyclopentyl)heptan-1-one
CID 116580217

Frequently Asked Questions

What is the IUPAC name of 1-(2-aminocyclopentyl)-2-cyclopentylethanone?
The IUPAC name of 1-(2-aminocyclopentyl)-2-cyclopentylethanone (CID 116580222) is 1-(2-aminocyclopentyl)-2-cyclopentylethanone.
What is the SMILES notation for 1-(2-aminocyclopentyl)-2-cyclopentylethanone?
The canonical SMILES for 1-(2-aminocyclopentyl)-2-cyclopentylethanone is NC1CCCC1C(=O)CC1CCCC1.
What is the InChIKey of 1-(2-aminocyclopentyl)-2-cyclopentylethanone?
The InChIKey is DFQVRCWQNFBKLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO/c13-11-7-3-6-10(11)12(14)8-9-4-1-2-5-9/h9-11H,1-8,13H2.
What are the key properties of 1-(2-aminocyclopentyl)-2-cyclopentylethanone?
1-(2-aminocyclopentyl)-2-cyclopentylethanone has a molecular weight of 195.31 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-aminocyclopentyl)-2-cyclopentylethanone is sourced from PubChem (CID 116580222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).