2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine

C12H25NO — CID 134907799

IUPAC2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine
SMILESCCCC1(CC)CC1(NC(C)C)OC
InChIInChI=1S/C12H25NO/c1-6-8-11(7-2)9-12(11,14-5)13-10(3)4/h10,13H,6-9H2,1-5H3
InChIKeyRJDFIJYLERYYEI-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.93
Rot. Bonds6

About 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine

2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine (PubChem CID 134907799) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine
PubChem CID134907799
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine
SMILESCCCC1(CC)CC1(NC(C)C)OC
InChIInChI=1S/C12H25NO/c1-6-8-11(7-2)9-12(11,14-5)13-10(3)4/h10,13H,6-9H2,1-5H3
InChIKeyRJDFIJYLERYYEI-UHFFFAOYSA-N
XLogP2.93
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2,2-diethyl-1-methoxy-N-propan-2-ylcyclopropan-1-amine
CID 85630940
2-ethyl-1-methoxy-2-methyl-N-propan-2-ylcyclopropan-1-amine
CID 134907889
2-butyl-1-methoxy-2-methyl-N-propan-2-ylcyclopropan-1-amine
CID 134907890
1-methoxy-2-methyl-N-propan-2-yl-2-propylcyclopropan-1-amine
CID 134975687
N-tert-butyl-1-methoxy-2-methyl-2-propylcyclopropan-1-amine
CID 134975781
N-tert-butyl-2-ethyl-1-methoxy-2-propylcyclopropan-1-amine
CID 134975949
2-butyl-2-ethyl-1-methoxy-N-propan-2-ylcyclopropan-1-amine
CID 134975982
N-[3,3-dimethyl-6-(2,2,2-trifluoroethoxy)hexyl]cyclopropanamine
CID 81023301
N-ethyl-6-methoxyspiro[2.3]hexan-4-amine
CID 167273954
(4S,6R)-6-methoxy-N-(2-methylpropyl)spiro[2.3]hexan-4-amine
CID 167273955
6-methoxy-N-(2-methylpropyl)spiro[2.3]hexan-4-amine
CID 167274048
N-[2-methyl-2-[2-(3-methylbutoxy)ethyl]pentyl]cyclopropanamine
CID 55106599

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine?
The IUPAC name of 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine (CID 134907799) is 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine.
What is the SMILES notation for 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine?
The canonical SMILES for 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine is CCCC1(CC)CC1(NC(C)C)OC.
What is the InChIKey of 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine?
The InChIKey is RJDFIJYLERYYEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-6-8-11(7-2)9-12(11,14-5)13-10(3)4/h10,13H,6-9H2,1-5H3.
What are the key properties of 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine?
2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine has a molecular weight of 199.34 g/mol, XLogP of 2.93, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-methoxy-N-propan-2-yl-2-propylcyclopropan-1-amine is sourced from PubChem (CID 134907799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).