N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide

C11H22N2O2 — CID 107529594

IUPACN-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide
SMILESCC(=O)NCCNCC1CCCC1CO
InChIInChI=1S/C11H22N2O2/c1-9(15)13-6-5-12-7-10-3-2-4-11(10)8-14/h10-12,14H,2-8H2,1H3,(H,13,15)
InChIKeyRIXBGQBHGCRFPD-UHFFFAOYSA-N
MW214.31 g/mol
LogP0.12
Rot. Bonds6

About N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide

N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide (PubChem CID 107529594) has the molecular formula C11H22N2O2 and a molecular weight of 214.31 g/mol. Its IUPAC name is N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide
PubChem CID107529594
Molecular FormulaC11H22N2O2
Molecular Weight214.31 g/mol
Exact Mass214.17
IUPAC NameN-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide
SMILESCC(=O)NCCNCC1CCCC1CO
InChIInChI=1S/C11H22N2O2/c1-9(15)13-6-5-12-7-10-3-2-4-11(10)8-14/h10-12,14H,2-8H2,1H3,(H,13,15)
InChIKeyRIXBGQBHGCRFPD-UHFFFAOYSA-N
XLogP0.12
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.31
LogP ≤ 50.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide 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

4-[(2-acetamidoethylamino)methyl]cyclohexane-1-carboxylic acid
CID 79532227
[2-[(2-propoxyethylamino)methyl]cyclopentyl]methanol
CID 106452162
5-[[2-(hydroxymethyl)cyclohexyl]methylamino]pentanoic acid
CID 103255247
[2-[(4-methylpentylamino)methyl]cyclohexyl]methanol
CID 83156139
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 66478079
4-[[2-(hydroxymethyl)cyclohexyl]methylamino]-2-methylbut-2-enoic acid
CID 103255243
[2-[[(3-chloro-2-methylprop-2-enyl)amino]methyl]cyclopentyl]methanol
CID 106437857
dimethyl carbonate;[2-(hydroxymethyl)cyclohexyl]methanol
CID 163689095
[2-[(4-methylsulfanylbutylamino)methyl]cyclohexyl]methanol
CID 103088118
acetic acid;[(1R,2R)-2-(hydroxymethyl)cycloheptyl]methanol
CID 71398880
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-methoxy-2-methylpropanamide
CID 103021126
N-(2-acetamidoethyl)-2-(methylaminomethyl)cyclohexane-1-carboxamide
CID 143733177

Frequently Asked Questions

What is the IUPAC name of N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide?
The IUPAC name of N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide (CID 107529594) is N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide.
What is the SMILES notation for N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide?
The canonical SMILES for N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide is CC(=O)NCCNCC1CCCC1CO.
What is the InChIKey of N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide?
The InChIKey is RIXBGQBHGCRFPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2/c1-9(15)13-6-5-12-7-10-3-2-4-11(10)8-14/h10-12,14H,2-8H2,1H3,(H,13,15).
What are the key properties of N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide?
N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide has a molecular weight of 214.31 g/mol, XLogP of 0.12, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[2-(hydroxymethyl)cyclopentyl]methylamino]ethyl]acetamide is sourced from PubChem (CID 107529594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).