3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine

C10H22N2O — CID 103539768

IUPAC3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine
SMILESCNCCC(C)N1CCC(OC)C1
InChIInChI=1S/C10H22N2O/c1-9(4-6-11-2)12-7-5-10(8-12)13-3/h9-11H,4-8H2,1-3H3
InChIKeyPIIOXBXCDGKDGY-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.71
Rot. Bonds5

About 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine

3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine (PubChem CID 103539768) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine.

Molecular Properties

Compound Name3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine
PubChem CID103539768
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC Name3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine
SMILESCNCCC(C)N1CCC(OC)C1
InChIInChI=1S/C10H22N2O/c1-9(4-6-11-2)12-7-5-10(8-12)13-3/h9-11H,4-8H2,1-3H3
InChIKeyPIIOXBXCDGKDGY-UHFFFAOYSA-N
XLogP0.71
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine 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

4-(3-methoxypiperidin-1-yl)-N-methylpentan-1-amine
CID 102968095
1-butan-2-yl-3-methoxypyrrolidine
CID 146427472
N-methyl-3-(4-methylpiperidin-1-yl)butan-1-amine
CID 62438267
4-(3-methoxypyrrolidin-1-yl)pentan-2-ol
CID 103537676
3-(3-methoxypiperidin-1-yl)-N-(2-methylpropyl)butan-1-amine
CID 102968159
4-(4-ethoxypiperidin-1-yl)-N-methylpentan-1-amine
CID 62427995
2-(3-methoxyazetidin-1-yl)-N-methylpropan-1-amine
CID 130548455
(3S)-1-(1,3-dichloropropan-2-yl)-3-methoxypyrrolidine
CID 162371914
2-(3-methoxypiperidin-1-yl)-N-propylpropan-1-amine
CID 102968134
N-[2-(3-methoxypiperidin-1-yl)propyl]-3-methylbutan-1-amine
CID 102968396
methyl 4-(3-methoxypyrrolidin-1-yl)-2-methyl-2-(propylamino)pentanoate
CID 103538071
N-tert-butyl-3-(3-methoxypyrrolidin-1-yl)-2-methylbutan-1-amine
CID 103539731

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine?
The IUPAC name of 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine (CID 103539768) is 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine.
What is the SMILES notation for 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine?
The canonical SMILES for 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine is CNCCC(C)N1CCC(OC)C1.
What is the InChIKey of 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine?
The InChIKey is PIIOXBXCDGKDGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-9(4-6-11-2)12-7-5-10(8-12)13-3/h9-11H,4-8H2,1-3H3.
What are the key properties of 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine?
3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine has a molecular weight of 186.30 g/mol, XLogP of 0.71, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypyrrolidin-1-yl)-N-methylbutan-1-amine is sourced from PubChem (CID 103539768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).