N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide

C9H16N2O2 — CID 130840758

IUPACN-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide
SMILESO=C(NCCO)N1C2CCC1CC2
InChIInChI=1S/C9H16N2O2/c12-6-5-10-9(13)11-7-1-2-8(11)4-3-7/h7-8,12H,1-6H2,(H,10,13)
InChIKeyYUBGDFZUKABIPY-UHFFFAOYSA-N
MW184.24 g/mol
LogP0.32
Rot. Bonds2

About N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide

N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide (PubChem CID 130840758) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide
PubChem CID130840758
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC NameN-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide
SMILESO=C(NCCO)N1C2CCC1CC2
InChIInChI=1S/C9H16N2O2/c12-6-5-10-9(13)11-7-1-2-8(11)4-3-7/h7-8,12H,1-6H2,(H,10,13)
InChIKeyYUBGDFZUKABIPY-UHFFFAOYSA-N
XLogP0.32
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 50.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-Cyclohexyl-N'-(2-hydroxyethyl)urea
CID 522238
1-[(1-cyclohexylpyrrolidin-2-yl)methyl]-3-[(2S)-2-hydroxypropyl]urea
CID 121535979
1-Cyclohexyl-4,5-dihydroxyimidazolidin-2-one
CID 130007322
1-Cyclohexyl-3-(1,1-dideuterio-2-hydroxyethyl)urea
CID 12696599
1,3-Dicyclopentyl-1-(2-hydroxyethyl)urea
CID 20300465
(2S)-N-cyclohexyl-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 53600598
1,3-Dicyclohexyl-1-(2-hydroxyethyl)urea
CID 54999035
N-cyclohexyl-2-(hydroxymethyl)pyrrolidine-1-carboxamide
CID 61408697
5-Butyl-1-(2-hydroxyethyl)imidazolidin-2-one
CID 68113601
1-(1-Aminohexan-3-yl)-3-methylimidazolidin-2-one;1-(2-hydroxyethyl)-3-piperidin-4-ylimidazolidin-2-one
CID 141886147
1-Ethyl-1-(2-hydroxyethyl)-3-[4-(methylamino)cyclohexyl]urea
CID 144158605
[4-(2-Hydroxyethylamino)cyclohexyl]urea
CID 175847309

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide (CID 130840758) is N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide is O=C(NCCO)N1C2CCC1CC2.
What is the InChIKey of N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide?
The InChIKey is YUBGDFZUKABIPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c12-6-5-10-9(13)11-7-1-2-8(11)4-3-7/h7-8,12H,1-6H2,(H,10,13).
What are the key properties of N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide?
N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide has a molecular weight of 184.24 g/mol, XLogP of 0.32, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-7-azabicyclo[2.2.1]heptane-7-carboxamide is sourced from PubChem (CID 130840758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).