2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide

C8H14N2O — CID 154478252

IUPAC2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide
SMILESNC(=O)C1CCN2CCCC12
InChIInChI=1S/C8H14N2O/c9-8(11)6-3-5-10-4-1-2-7(6)10/h6-7H,1-5H2,(H2,9,11)
InChIKeyAHILFVRBSKPLBX-UHFFFAOYSA-N
MW154.21 g/mol
LogP-0.04
Rot. Bonds1

About 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide

2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide (PubChem CID 154478252) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide.

Molecular Properties

Compound Name2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide
PubChem CID154478252
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide
SMILESNC(=O)C1CCN2CCCC12
InChIInChI=1S/C8H14N2O/c9-8(11)6-3-5-10-4-1-2-7(6)10/h6-7H,1-5H2,(H2,9,11)
InChIKeyAHILFVRBSKPLBX-UHFFFAOYSA-N
XLogP-0.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-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

1,2,3,5,6,7,8,8a-octahydroindolizine-1-carboxylic acid
CID 82653045
1,2,3,5,6,7,8,8a-octahydroindolizine-8-carboxylic acid
CID 75987984
(1S,9aR)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine-1-carboxylic acid
CID 7758382
3-piperidin-1-ylpiperidine-4-carboxamide
CID 154464995
4-(azetidin-1-yl)-3-carbamoylpiperidine-1-carboxylic acid
CID 68728558
4-(2,3,5,6,7,8-hexahydro-1H-pyrrolizin-1-ylamino)cyclohexane-1-carboxamide
CID 82853124
1-[(1R,2R)-2-hydroxycyclopentyl]piperidine-4-carboxamide
CID 102734306
2-pyrrolidin-1-ylcyclohexane-1-carbohydrazide;hydrochloride
CID 21276976
pyrrolidin-1-yl-[(1R,2R)-2-pyrrolidin-1-ylcyclohexyl]methanone
CID 125474044
2-(4-ethylazepan-1-yl)cyclobutane-1-carboxylic acid
CID 80995975
(3R,4S)-4-(azetidin-1-yl)piperidine-3-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 133112906
(3S,4S)-4-(azetidin-1-yl)piperidine-3-carboxamide;bis(2,2,2-trifluoroacetic acid)
CID 126970170

Frequently Asked Questions

What is the IUPAC name of 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide?
The IUPAC name of 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide (CID 154478252) is 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide.
What is the SMILES notation for 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide?
The canonical SMILES for 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide is NC(=O)C1CCN2CCCC12.
What is the InChIKey of 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide?
The InChIKey is AHILFVRBSKPLBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c9-8(11)6-3-5-10-4-1-2-7(6)10/h6-7H,1-5H2,(H2,9,11).
What are the key properties of 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide?
2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide has a molecular weight of 154.21 g/mol, XLogP of -0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5,6,7,8-hexahydro-1H-pyrrolizine-1-carboxamide is sourced from PubChem (CID 154478252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).