N,N-dimethyl-1-(oxiran-2-yl)methanamine

C10H22N2O2 — CID 161234843

IUPACN,N-dimethyl-1-(oxiran-2-yl)methanamine
SMILESCN(C)CC1CO1.CN(C)CC1CO1
InChIInChI=1S/2C5H11NO/c2*1-6(2)3-5-4-7-5/h2*5H,3-4H2,1-2H3
InChIKeyUZFUDTDEFPOEQG-UHFFFAOYSA-N
MW202.30 g/mol
LogP-0.11
Rot. Bonds4

About N,N-dimethyl-1-(oxiran-2-yl)methanamine

N,N-dimethyl-1-(oxiran-2-yl)methanamine (PubChem CID 161234843) has the molecular formula C10H22N2O2 and a molecular weight of 202.30 g/mol. Its IUPAC name is N,N-dimethyl-1-(oxiran-2-yl)methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-(oxiran-2-yl)methanamine
PubChem CID161234843
Molecular FormulaC10H22N2O2
Molecular Weight202.30 g/mol
Exact Mass202.17
IUPAC NameN,N-dimethyl-1-(oxiran-2-yl)methanamine
SMILESCN(C)CC1CO1.CN(C)CC1CO1
InChIInChI=1S/2C5H11NO/c2*1-6(2)3-5-4-7-5/h2*5H,3-4H2,1-2H3
InChIKeyUZFUDTDEFPOEQG-UHFFFAOYSA-N
XLogP-0.11
TPSA31.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 5-0.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethyl-1-(oxiran-2-yl)methanamine;1,3,5-tris(oxiran-2-ylmethyl)-1,3,5-triazinane-2,4,6-trione
CID 160936317
N,N-dimethyl-N'-(oxiran-2-ylmethyl)-N'-[[(2R)-oxiran-2-yl]methyl]methanediamine
CID 166989099
N-iodo-N-methyl-1-(oxiran-2-yl)methanamine
CID 118696490
N,N-dimethyl-1-(oxiran-2-yl)methanamine;2-methylidenebutanedioic acid
CID 18955534
N,N-dimethyl-1-(5-methyloxan-2-yl)methanamine
CID 155367091
N,N-dimethyl-1-[(2S)-oxolan-2-yl]methanamine
CID 89026085
N,N-dimethyl-1-[(5R)-5-methylmorpholin-2-yl]methanamine
CID 142866340
N,N-dimethyl-1-[(2R,5R)-5-methylmorpholin-2-yl]methanamine
CID 45088569
methyl(oxiran-2-ylmethyl)carbamic acid
CID 87093362
N-methyl-1-(2-methylcyclopropyl)-N-(oxiran-2-ylmethyl)methanamine
CID 63865680
azane;N,N-dimethyl-2-(oxiran-2-yl)ethanamine;hydrochloride
CID 174892237
2-(bromomethyl)oxirane;N,N-dimethylmethanamine
CID 87110477

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-(oxiran-2-yl)methanamine?
The IUPAC name of N,N-dimethyl-1-(oxiran-2-yl)methanamine (CID 161234843) is N,N-dimethyl-1-(oxiran-2-yl)methanamine.
What is the SMILES notation for N,N-dimethyl-1-(oxiran-2-yl)methanamine?
The canonical SMILES for N,N-dimethyl-1-(oxiran-2-yl)methanamine is CN(C)CC1CO1.CN(C)CC1CO1.
What is the InChIKey of N,N-dimethyl-1-(oxiran-2-yl)methanamine?
The InChIKey is UZFUDTDEFPOEQG-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H11NO/c2*1-6(2)3-5-4-7-5/h2*5H,3-4H2,1-2H3.
What are the key properties of N,N-dimethyl-1-(oxiran-2-yl)methanamine?
N,N-dimethyl-1-(oxiran-2-yl)methanamine has a molecular weight of 202.30 g/mol, XLogP of -0.11, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-(oxiran-2-yl)methanamine is sourced from PubChem (CID 161234843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).