N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine

C10H21NO2 — CID 103074460

IUPACN-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine
SMILESC=C(CNC)COCCOC(C)C
InChIInChI=1S/C10H21NO2/c1-9(2)13-6-5-12-8-10(3)7-11-4/h9,11H,3,5-8H2,1-2,4H3
InChIKeyWQBFQDRWBZRGER-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.20
Rot. Bonds8

About N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine

N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine (PubChem CID 103074460) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine
PubChem CID103074460
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC NameN-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine
SMILESC=C(CNC)COCCOC(C)C
InChIInChI=1S/C10H21NO2/c1-9(2)13-6-5-12-8-10(3)7-11-4/h9,11H,3,5-8H2,1-2,4H3
InChIKeyWQBFQDRWBZRGER-UHFFFAOYSA-N
XLogP1.20
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-2-[3-(methylamino)propoxymethyl]prop-2-en-1-amine
CID 89501895
N-methyl-3-(2-methylprop-2-enoxy)propan-1-amine
CID 163401473
2-(ethoxymethyl)-N-ethylprop-2-en-1-amine
CID 103074363
2-(ethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074367
2-(2-ethoxyethoxymethyl)-N-ethylprop-2-en-1-amine
CID 103074370
2-(2-ethoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103074372
N-tert-butyl-2-(2-ethoxyethoxymethyl)prop-2-en-1-amine
CID 103074373
2-(2-ethoxyethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074374
2-(2-Ethoxyethoxymethyl)prop-2-en-1-amine
CID 103074375
2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine
CID 103074376
N-ethyl-2-(2-methoxyethoxymethyl)prop-2-en-1-amine
CID 103074415
2-(2-methoxyethoxymethyl)-N-propan-2-ylprop-2-en-1-amine
CID 103074417

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine?
The IUPAC name of N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine (CID 103074460) is N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine.
What is the SMILES notation for N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine?
The canonical SMILES for N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine is C=C(CNC)COCCOC(C)C.
What is the InChIKey of N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine?
The InChIKey is WQBFQDRWBZRGER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-9(2)13-6-5-12-8-10(3)7-11-4/h9,11H,3,5-8H2,1-2,4H3.
What are the key properties of N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine?
N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine has a molecular weight of 187.28 g/mol, XLogP of 1.20, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-propan-2-yloxyethoxymethyl)prop-2-en-1-amine is sourced from PubChem (CID 103074460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).