2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol

C10H21NO3 — CID 114756082

IUPAC2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol
SMILESCOC(CNCC1(CCO)CC1)OC
InChIInChI=1S/C10H21NO3/c1-13-9(14-2)7-11-8-10(3-4-10)5-6-12/h9,11-12H,3-8H2,1-2H3
InChIKeyUZAASUZRQPONAM-UHFFFAOYSA-N
MW203.28 g/mol
LogP0.36
Rot. Bonds8

About 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol

2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol (PubChem CID 114756082) has the molecular formula C10H21NO3 and a molecular weight of 203.28 g/mol. Its IUPAC name is 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol.

Molecular Properties

Compound Name2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol
PubChem CID114756082
Molecular FormulaC10H21NO3
Molecular Weight203.28 g/mol
Exact Mass203.15
IUPAC Name2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol
SMILESCOC(CNCC1(CCO)CC1)OC
InChIInChI=1S/C10H21NO3/c1-13-9(14-2)7-11-8-10(3-4-10)5-6-12/h9,11-12H,3-8H2,1-2H3
InChIKeyUZAASUZRQPONAM-UHFFFAOYSA-N
XLogP0.36
TPSA50.72 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol 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-[(2,2-diethoxyethylamino)methyl]cyclopropyl]methanol
CID 115454682
2-[1-[[2-[2-(2-methoxyethoxy)ethoxy]ethylamino]methyl]cyclopropyl]ethanol
CID 114756460
1-(dimethylamino)-3-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]propan-2-ol
CID 114756465
2-[1-(propylaminomethyl)cyclopropyl]ethanol
CID 114756075
2-[1-[[2-(3-methoxypropoxy)ethylamino]methyl]cyclopropyl]ethanol
CID 103179565
2-[[1-(2-hydroxyethyl)cyclopropyl]methylamino]-1-phenylethanol
CID 114756302
2-[1-[(2-methylidenebutylamino)methyl]cyclopropyl]ethanol
CID 114756336
2-[1-[[(3,5-dimethoxyphenyl)methylamino]methyl]cyclopropyl]ethanol
CID 114750236
2-[1-[[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]methyl]cyclopropyl]ethanol
CID 114749654
2-[1-[(butan-2-ylamino)methyl]cyclopropyl]ethanol
CID 114750802
N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-methoxyacetamide
CID 114751101
ethyl 2-[[[1-(2-hydroxyethyl)cyclopropyl]methylamino]methyl]prop-2-enoate
CID 103269315

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol?
The IUPAC name of 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol (CID 114756082) is 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol.
What is the SMILES notation for 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol?
The canonical SMILES for 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol is COC(CNCC1(CCO)CC1)OC.
What is the InChIKey of 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol?
The InChIKey is UZAASUZRQPONAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO3/c1-13-9(14-2)7-11-8-10(3-4-10)5-6-12/h9,11-12H,3-8H2,1-2H3.
What are the key properties of 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol?
2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol has a molecular weight of 203.28 g/mol, XLogP of 0.36, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2,2-dimethoxyethylamino)methyl]cyclopropyl]ethanol is sourced from PubChem (CID 114756082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).