N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine

C9H19NO — CID 103074428

IUPACN-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine
SMILESC=C(CNC)COCC(C)C
InChIInChI=1S/C9H19NO/c1-8(2)6-11-7-9(3)5-10-4/h8,10H,3,5-7H2,1-2,4H3
InChIKeyYVZZVZMRBOFQLJ-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.43
Rot. Bonds6

About N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine

N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine (PubChem CID 103074428) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine
PubChem CID103074428
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine
SMILESC=C(CNC)COCC(C)C
InChIInChI=1S/C9H19NO/c1-8(2)6-11-7-9(3)5-10-4/h8,10H,3,5-7H2,1-2,4H3
InChIKeyYVZZVZMRBOFQLJ-UHFFFAOYSA-N
XLogP1.43
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.43
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-propyl-2-(2,2,2-trifluoroethoxymethyl)prop-2-en-1-amine
CID 103074346
N-methyl-2-(2,2,3,3-tetrafluoropropoxymethyl)prop-2-en-1-amine
CID 103074501
N-methyl-2-(2,2,3,3,3-pentafluoropropoxymethyl)prop-2-en-1-amine
CID 103074935
2-(2,2-difluoroethoxymethyl)-N-propylprop-2-en-1-amine
CID 103075031
N-methyl-2-(4,4,4-trifluorobutoxymethyl)prop-2-en-1-amine
CID 103075047
N-ethyl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075053
N-propyl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075059
N-methyl-2-(3,3,3-trifluoropropoxymethyl)prop-2-en-1-amine
CID 103075061
N-methyl-2-[3-(methylamino)propoxymethyl]prop-2-en-1-amine
CID 89501895
1-methoxy-N,2-dimethylprop-2-en-1-amine
CID 129016738
3-(2-methylprop-2-enoxy)-N-prop-2-enylpropan-1-amine
CID 142038525
N-methyl-3-(2-methylprop-2-enoxy)propan-1-amine
CID 163401473

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine?
The IUPAC name of N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine (CID 103074428) is N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine.
What is the SMILES notation for N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine?
The canonical SMILES for N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine is C=C(CNC)COCC(C)C.
What is the InChIKey of N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine?
The InChIKey is YVZZVZMRBOFQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-8(2)6-11-7-9(3)5-10-4/h8,10H,3,5-7H2,1-2,4H3.
What are the key properties of N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine?
N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine has a molecular weight of 157.26 g/mol, XLogP of 1.43, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(2-methylpropoxymethyl)prop-2-en-1-amine is sourced from PubChem (CID 103074428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).