ethane;4-(hydroxymethyl)piperidine-1-carboxamide

C9H20N2O2 — CID 144841016

IUPACethane;4-(hydroxymethyl)piperidine-1-carboxamide
SMILESCC.NC(=O)N1CCC(CO)CC1
InChIInChI=1S/C7H14N2O2.C2H6/c8-7(11)9-3-1-6(5-10)2-4-9;1-2/h6,10H,1-5H2,(H2,8,11);1-2H3
InChIKeyHNHVEYSEBXLSDJ-UHFFFAOYSA-N
MW188.27 g/mol
LogP0.80
Rot. Bonds1

About ethane;4-(hydroxymethyl)piperidine-1-carboxamide

ethane;4-(hydroxymethyl)piperidine-1-carboxamide (PubChem CID 144841016) has the molecular formula C9H20N2O2 and a molecular weight of 188.27 g/mol. Its IUPAC name is ethane;4-(hydroxymethyl)piperidine-1-carboxamide.

Molecular Properties

Compound Nameethane;4-(hydroxymethyl)piperidine-1-carboxamide
PubChem CID144841016
Molecular FormulaC9H20N2O2
Molecular Weight188.27 g/mol
Exact Mass188.15
IUPAC Nameethane;4-(hydroxymethyl)piperidine-1-carboxamide
SMILESCC.NC(=O)N1CCC(CO)CC1
InChIInChI=1S/C7H14N2O2.C2H6/c8-7(11)9-3-1-6(5-10)2-4-9;1-2/h6,10H,1-5H2,(H2,8,11);1-2H3
InChIKeyHNHVEYSEBXLSDJ-UHFFFAOYSA-N
XLogP0.80
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze ethane;4-(hydroxymethyl)piperidine-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

N,N-diethyl-4-[(1S)-2,2,2-trifluoro-1-hydroxyethyl]piperidine-1-carboxamide
CID 97239660
N,N-diethyl-4-(2,2,2-trifluoro-1-hydroxyethyl)piperidine-1-carboxamide
CID 75387290
N,N-diethyl-4-[(1R)-2,2,2-trifluoro-1-hydroxyethyl]piperidine-1-carboxamide
CID 97239661
4-(1-hydroxyethyl)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 103657827
4-(hydroxymethyl)-N-(2,2,2-trifluoroethyl)piperidine-1-carboxamide
CID 110896383
4-(hydroxymethyl)-N-(3,3,3-trifluoropropyl)piperidine-1-carboxamide
CID 111509207
4-(Hydroxymethyl)piperidine-1-carboxamide
CID 54594894
N-tert-butyl-4-(2-hydroxyethyl)piperidine-1-carboxamide
CID 57670406
N-tert-butyl-4-(hydroxymethyl)piperidine-1-carboxamide
CID 57670487
[4-(Hydroxymethyl)piperidin-1-yl]-pyrrolidin-1-ylmethanone
CID 59510490
N-(3-hydroxypropyl)-4-propan-2-ylpiperidine-1-carboxamide
CID 59542604
N-butyl-4-(hydroxymethyl)piperidine-1-carboxamide
CID 60781158

Frequently Asked Questions

What is the IUPAC name of ethane;4-(hydroxymethyl)piperidine-1-carboxamide?
The IUPAC name of ethane;4-(hydroxymethyl)piperidine-1-carboxamide (CID 144841016) is ethane;4-(hydroxymethyl)piperidine-1-carboxamide.
What is the SMILES notation for ethane;4-(hydroxymethyl)piperidine-1-carboxamide?
The canonical SMILES for ethane;4-(hydroxymethyl)piperidine-1-carboxamide is CC.NC(=O)N1CCC(CO)CC1.
What is the InChIKey of ethane;4-(hydroxymethyl)piperidine-1-carboxamide?
The InChIKey is HNHVEYSEBXLSDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O2.C2H6/c8-7(11)9-3-1-6(5-10)2-4-9;1-2/h6,10H,1-5H2,(H2,8,11);1-2H3.
What are the key properties of ethane;4-(hydroxymethyl)piperidine-1-carboxamide?
ethane;4-(hydroxymethyl)piperidine-1-carboxamide has a molecular weight of 188.27 g/mol, XLogP of 0.80, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-(hydroxymethyl)piperidine-1-carboxamide is sourced from PubChem (CID 144841016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).