3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide

C12H22N2O2 — CID 66008154

IUPAC3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCCC2CCCO2)C1
InChIInChI=1S/C12H22N2O2/c13-10-4-3-9(8-10)12(15)14-6-5-11-2-1-7-16-11/h9-11H,1-8,13H2,(H,14,15)
InChIKeyKBHGGZSHLGQMIO-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.80
Rot. Bonds4

About 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide

3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide (PubChem CID 66008154) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide
PubChem CID66008154
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC Name3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide
SMILESNC1CCC(C(=O)NCCC2CCCO2)C1
InChIInChI=1S/C12H22N2O2/c13-10-4-3-9(8-10)12(15)14-6-5-11-2-1-7-16-11/h9-11H,1-8,13H2,(H,14,15)
InChIKeyKBHGGZSHLGQMIO-UHFFFAOYSA-N
XLogP0.80
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[2-(oxolan-2-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 63782308
3-amino-N-(2-cyclopentylethyl)cyclopentane-1-carboxamide
CID 66010406
N-[2-(oxan-2-yl)ethyl]bicyclo[3.1.0]hexane-3-carboxamide
CID 106000950
2-amino-3-methyl-N-[2-(oxolan-2-yl)ethyl]cyclohexane-1-carboxamide
CID 55117010
cis-oxolan-2-ylmethyl (1R,3S)-3-aminocyclopentane-1-carboxylate
CID 106323805
1-(4-aminocyclohexyl)-3-(oxolan-2-yl)propan-1-one
CID 116557342
2,2-dimethyl-3-[2-(oxolan-2-yl)ethylcarbamoyl]cyclopropane-1-carboxylic acid
CID 64835996
3-amino-N-[2-(cyclopropanecarbonylamino)ethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119687746
3-[(3-aminocyclopentanecarbonyl)amino]propanoic acid
CID 66009608
methyl N-[2-(oxolan-2-yl)ethyl]carbamate
CID 110731266
3-oxo-3-[2-(oxolan-2-yl)ethylamino]propanoic acid
CID 62230104
3-amino-N-[2-(azepan-1-yl)ethyl]cyclopentane-1-carboxamide
CID 66008993

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide (CID 66008154) is 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide is NC1CCC(C(=O)NCCC2CCCO2)C1.
What is the InChIKey of 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide?
The InChIKey is KBHGGZSHLGQMIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c13-10-4-3-9(8-10)12(15)14-6-5-11-2-1-7-16-11/h9-11H,1-8,13H2,(H,14,15).
What are the key properties of 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide?
3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide has a molecular weight of 226.32 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(oxolan-2-yl)ethyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 66008154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).