2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine

C11H21NO — CID 103074727

IUPAC2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine
SMILESC=C(CNCCC)COC1CCC1
InChIInChI=1S/C11H21NO/c1-3-7-12-8-10(2)9-13-11-5-4-6-11/h11-12H,2-9H2,1H3
InChIKeyKBTQNZAUYSVVCB-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.11
Rot. Bonds7

About 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine

2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine (PubChem CID 103074727) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine.

Molecular Properties

Compound Name2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine
PubChem CID103074727
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine
SMILESC=C(CNCCC)COC1CCC1
InChIInChI=1S/C11H21NO/c1-3-7-12-8-10(2)9-13-11-5-4-6-11/h11-12H,2-9H2,1H3
InChIKeyKBTQNZAUYSVVCB-UHFFFAOYSA-N
XLogP2.11
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-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-[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
3-methoxy-N-(2-methylprop-2-enyl)cyclobutan-1-amine
CID 102673491
N-ethyl-2-(prop-2-enoxymethyl)prop-2-en-1-amine
CID 103074315
2-(prop-2-enoxymethyl)-N-propylprop-2-en-1-amine
CID 103074319
2-(cyclohexyloxymethyl)-N-ethylprop-2-en-1-amine
CID 103074322
2-(cyclohexyloxymethyl)-N-propylprop-2-en-1-amine
CID 103074326
2-(cyclopentyloxymethyl)-N-ethylprop-2-en-1-amine
CID 103074329

Frequently Asked Questions

What is the IUPAC name of 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine?
The IUPAC name of 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine (CID 103074727) is 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine.
What is the SMILES notation for 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine?
The canonical SMILES for 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine is C=C(CNCCC)COC1CCC1.
What is the InChIKey of 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine?
The InChIKey is KBTQNZAUYSVVCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-7-12-8-10(2)9-13-11-5-4-6-11/h11-12H,2-9H2,1H3.
What are the key properties of 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine?
2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine has a molecular weight of 183.29 g/mol, XLogP of 2.11, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclobutyloxymethyl)-N-propylprop-2-en-1-amine is sourced from PubChem (CID 103074727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).