(2-aminocycloheptyl)-cyclopentylmethanone

C13H23NO — CID 116595079

IUPAC(2-aminocycloheptyl)-cyclopentylmethanone
SMILESNC1CCCCCC1C(=O)C1CCCC1
InChIInChI=1S/C13H23NO/c14-12-9-3-1-2-8-11(12)13(15)10-6-4-5-7-10/h10-12H,1-9,14H2
InChIKeyLHUHSAMYKFNCMB-UHFFFAOYSA-N
MW209.33 g/mol
LogP2.65
Rot. Bonds2

About (2-aminocycloheptyl)-cyclopentylmethanone

(2-aminocycloheptyl)-cyclopentylmethanone (PubChem CID 116595079) has the molecular formula C13H23NO and a molecular weight of 209.33 g/mol. Its IUPAC name is (2-aminocycloheptyl)-cyclopentylmethanone.

Molecular Properties

Compound Name(2-aminocycloheptyl)-cyclopentylmethanone
PubChem CID116595079
Molecular FormulaC13H23NO
Molecular Weight209.33 g/mol
Exact Mass209.18
IUPAC Name(2-aminocycloheptyl)-cyclopentylmethanone
SMILESNC1CCCCCC1C(=O)C1CCCC1
InChIInChI=1S/C13H23NO/c14-12-9-3-1-2-8-11(12)13(15)10-6-4-5-7-10/h10-12H,1-9,14H2
InChIKeyLHUHSAMYKFNCMB-UHFFFAOYSA-N
XLogP2.65
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.33
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-aminocyclohexyl)-cycloheptylmethanone
CID 116580013
(2-aminocycloheptyl)-cyclopropylmethanone
CID 116595315
cis-(1R,2S)-2-aminocycloheptane-1-carboxylic acid;cis-(1S,2R)-2-aminocycloheptane-1-carboxylic acid
CID 127239829
trans-(1R,2R)-2-aminocycloheptane-1-carboxamide
CID 95970217
[(1S,2R)-2-(aminomethyl)cyclopentyl]-cyclohexylmethanone
CID 130649723
(4-aminooxolan-3-yl)-cyclohexylmethanone
CID 116587386
(2-aminocyclopentyl)-(oxan-3-yl)methanone
CID 107138398
trans-(1S,2S)-2-aminocycloheptane-1-carboxylic acid;hydrochloride
CID 131632809
cis-(1R,2S)-2-aminocyclohexane-1-carboxylic acid
CID 2724639
cis-(1R,2S)-2-aminocyclohexane-1-carboxylic acid;hydrobromide
CID 24751167
1-(2-aminocyclohexyl)ethanone;ethane
CID 176999507
1-[(1R)-2-aminocyclohexyl]ethanone;hydrobromide
CID 90964979

Frequently Asked Questions

What is the IUPAC name of (2-aminocycloheptyl)-cyclopentylmethanone?
The IUPAC name of (2-aminocycloheptyl)-cyclopentylmethanone (CID 116595079) is (2-aminocycloheptyl)-cyclopentylmethanone.
What is the SMILES notation for (2-aminocycloheptyl)-cyclopentylmethanone?
The canonical SMILES for (2-aminocycloheptyl)-cyclopentylmethanone is NC1CCCCCC1C(=O)C1CCCC1.
What is the InChIKey of (2-aminocycloheptyl)-cyclopentylmethanone?
The InChIKey is LHUHSAMYKFNCMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO/c14-12-9-3-1-2-8-11(12)13(15)10-6-4-5-7-10/h10-12H,1-9,14H2.
What are the key properties of (2-aminocycloheptyl)-cyclopentylmethanone?
(2-aminocycloheptyl)-cyclopentylmethanone has a molecular weight of 209.33 g/mol, XLogP of 2.65, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-aminocycloheptyl)-cyclopentylmethanone is sourced from PubChem (CID 116595079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).