2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine

C9H17NO — CID 103074583

IUPAC2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COCC1CC1
InChIInChI=1S/C9H17NO/c1-8(5-10-2)6-11-7-9-3-4-9/h9-10H,1,3-7H2,2H3
InChIKeyUPTXICKCMBXLAM-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.19
Rot. Bonds6

About 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine

2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine (PubChem CID 103074583) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine
PubChem CID103074583
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine
SMILESC=C(CNC)COCC1CC1
InChIInChI=1S/C9H17NO/c1-8(5-10-2)6-11-7-9-3-4-9/h9-10H,1,3-7H2,2H3
InChIKeyUPTXICKCMBXLAM-UHFFFAOYSA-N
XLogP1.19
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
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-methyl-2-(4,4,4-trifluorobutoxymethyl)prop-2-en-1-amine
CID 103075047
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
N-methyl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074321
2-(methoxymethyl)-N-propylprop-2-en-1-amine
CID 103074360
2-(ethoxymethyl)-N-ethylprop-2-en-1-amine
CID 103074363
N-[2-(ethoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074364
2-(ethoxymethyl)-N-propylprop-2-en-1-amine
CID 103074367
2-(ethoxymethyl)-N-methylprop-2-en-1-amine
CID 103074369
2-(2-ethoxyethoxymethyl)-N-methylprop-2-en-1-amine
CID 103074376
N-ethyl-2-(3-methylbutoxymethyl)prop-2-en-1-amine
CID 103074382
N-[2-(3-methylbutoxymethyl)prop-2-enyl]cyclopropanamine
CID 103074383

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine?
The IUPAC name of 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine (CID 103074583) is 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine.
What is the SMILES notation for 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine?
The canonical SMILES for 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine is C=C(CNC)COCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine?
The InChIKey is UPTXICKCMBXLAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-8(5-10-2)6-11-7-9-3-4-9/h9-10H,1,3-7H2,2H3.
What are the key properties of 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine?
2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxymethyl)-N-methylprop-2-en-1-amine is sourced from PubChem (CID 103074583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).