(1-aminocyclopentyl)-(azepan-1-yl)methanone

C12H22N2O — CID 60867017

IUPAC(1-aminocyclopentyl)-(azepan-1-yl)methanone
SMILESNC1(C(=O)N2CCCCCC2)CCCC1
InChIInChI=1S/C12H22N2O/c13-12(7-3-4-8-12)11(15)14-9-5-1-2-6-10-14/h1-10,13H2
InChIKeyLNZPNUKWYUNBME-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.66
Rot. Bonds1

About (1-aminocyclopentyl)-(azepan-1-yl)methanone

(1-aminocyclopentyl)-(azepan-1-yl)methanone (PubChem CID 60867017) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is (1-aminocyclopentyl)-(azepan-1-yl)methanone.

Molecular Properties

Compound Name(1-aminocyclopentyl)-(azepan-1-yl)methanone
PubChem CID60867017
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name(1-aminocyclopentyl)-(azepan-1-yl)methanone
SMILESNC1(C(=O)N2CCCCCC2)CCCC1
InChIInChI=1S/C12H22N2O/c13-12(7-3-4-8-12)11(15)14-9-5-1-2-6-10-14/h1-10,13H2
InChIKeyLNZPNUKWYUNBME-UHFFFAOYSA-N
XLogP1.66
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1-aminocyclopentyl)-(azepan-1-yl)methanone?
The IUPAC name of (1-aminocyclopentyl)-(azepan-1-yl)methanone (CID 60867017) is (1-aminocyclopentyl)-(azepan-1-yl)methanone.
What is the SMILES notation for (1-aminocyclopentyl)-(azepan-1-yl)methanone?
The canonical SMILES for (1-aminocyclopentyl)-(azepan-1-yl)methanone is NC1(C(=O)N2CCCCCC2)CCCC1.
What is the InChIKey of (1-aminocyclopentyl)-(azepan-1-yl)methanone?
The InChIKey is LNZPNUKWYUNBME-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c13-12(7-3-4-8-12)11(15)14-9-5-1-2-6-10-14/h1-10,13H2.
What are the key properties of (1-aminocyclopentyl)-(azepan-1-yl)methanone?
(1-aminocyclopentyl)-(azepan-1-yl)methanone has a molecular weight of 210.32 g/mol, XLogP of 1.66, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-aminocyclopentyl)-(azepan-1-yl)methanone is sourced from PubChem (CID 60867017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).