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

C8H17NO — CID 103074440

IUPACN-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine
SMILESC=C(CNC)COC(C)C
InChIInChI=1S/C8H17NO/c1-7(2)10-6-8(3)5-9-4/h7,9H,3,5-6H2,1-2,4H3
InChIKeyCWWKBNXKYYHNAZ-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.19
Rot. Bonds5

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

N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine (PubChem CID 103074440) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine
PubChem CID103074440
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC NameN-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine
SMILESC=C(CNC)COC(C)C
InChIInChI=1S/C8H17NO/c1-7(2)10-6-8(3)5-9-4/h7,9H,3,5-6H2,1-2,4H3
InChIKeyCWWKBNXKYYHNAZ-UHFFFAOYSA-N
XLogP1.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-(1,1,1-trifluoropropan-2-yloxymethyl)prop-2-en-1-amine
CID 103074886
N-propyl-2-(1,1,1-trifluoropropan-2-yloxymethyl)prop-2-en-1-amine
CID 103074892
N-methyl-2-(1,1,1-trifluoropropan-2-yloxymethyl)prop-2-en-1-amine
CID 103074894
N-methyl-2-(4,4,4-trifluorobutoxymethyl)prop-2-en-1-amine
CID 103075047
N-methyl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075061
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxymethyl)-N-methylprop-2-en-1-amine
CID 103075214
N-methyl-2-[3-(methylamino)propoxymethyl]prop-2-en-1-amine
CID 89501895
3-(2-methylprop-2-enoxy)-N-prop-2-enylpropan-1-amine
CID 142038525
3-(3-methylbut-3-en-2-yloxy)-N-prop-2-enylpropan-1-amine;molecular hydrogen
CID 142038615
N-methyl-3-(2-methylprop-2-enoxy)propan-1-amine
CID 163401473
2-[2-(dimethylamino)ethoxymethyl]-N-methylprop-2-en-1-amine
CID 164002361
N-methyl-2-(2-methylprop-2-enoxy)propan-1-amine
CID 62337990

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine?
The IUPAC name of N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine (CID 103074440) is N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine.
What is the SMILES notation for N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine?
The canonical SMILES for N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine is C=C(CNC)COC(C)C.
What is the InChIKey of N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine?
The InChIKey is CWWKBNXKYYHNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-7(2)10-6-8(3)5-9-4/h7,9H,3,5-6H2,1-2,4H3.
What are the key properties of N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine?
N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine has a molecular weight of 143.23 g/mol, XLogP of 1.19, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(propan-2-yloxymethyl)prop-2-en-1-amine is sourced from PubChem (CID 103074440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).