N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine

C12H21N3O — CID 65328911

IUPACN-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine
SMILESCCCn1ccnc1C(NC)C1CCCO1
InChIInChI=1S/C12H21N3O/c1-3-7-15-8-6-14-12(15)11(13-2)10-5-4-9-16-10/h6,8,10-11,13H,3-5,7,9H2,1-2H3
InChIKeyXNEXLQGSBUCPEW-UHFFFAOYSA-N
MW223.32 g/mol
LogP1.73
Rot. Bonds5

About N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine

N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine (PubChem CID 65328911) has the molecular formula C12H21N3O and a molecular weight of 223.32 g/mol. Its IUPAC name is N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine
PubChem CID65328911
Molecular FormulaC12H21N3O
Molecular Weight223.32 g/mol
Exact Mass223.17
IUPAC NameN-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine
SMILESCCCn1ccnc1C(NC)C1CCCO1
InChIInChI=1S/C12H21N3O/c1-3-7-15-8-6-14-12(15)11(13-2)10-5-4-9-16-10/h6,8,10-11,13H,3-5,7,9H2,1-2H3
InChIKeyXNEXLQGSBUCPEW-UHFFFAOYSA-N
XLogP1.73
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[oxan-2-yl-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 115859031
oxolan-2-yl-(1-propylimidazol-2-yl)methanamine
CID 65331088
N-methyl-1-(oxan-3-yl)-1-(1-propylimidazol-2-yl)methanamine
CID 65332085
1-cyclooctyl-N-methyl-1-(1-propylimidazol-2-yl)methanamine
CID 80603549
N-methyl-1-(oxolan-2-yl)-2-(1-propylimidazol-2-yl)ethanamine
CID 79761761
N-[1,4-oxathian-2-yl-(1-propylimidazol-2-yl)methyl]ethanamine
CID 79962860
1-(oxan-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 115821107
[(4-propan-2-ylmorpholin-2-yl)-(1-propylimidazol-2-yl)methyl]hydrazine
CID 105248109
(1-ethylimidazol-2-yl)-(oxan-2-yl)methanamine
CID 115860223
N-[oxolan-3-yl-(1-propylimidazol-2-yl)methyl]propan-1-amine
CID 65329600
(4-methylmorpholin-2-yl)-(1-propylimidazol-2-yl)methanol
CID 79087761
oxan-3-yl-(1-propylimidazol-2-yl)methanamine
CID 65332241

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine?
The IUPAC name of N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine (CID 65328911) is N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine is CCCn1ccnc1C(NC)C1CCCO1.
What is the InChIKey of N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine?
The InChIKey is XNEXLQGSBUCPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O/c1-3-7-15-8-6-14-12(15)11(13-2)10-5-4-9-16-10/h6,8,10-11,13H,3-5,7,9H2,1-2H3.
What are the key properties of N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine?
N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine has a molecular weight of 223.32 g/mol, XLogP of 1.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(oxolan-2-yl)-1-(1-propylimidazol-2-yl)methanamine is sourced from PubChem (CID 65328911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).