4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine

C13H26N2O2 — CID 103534665

IUPAC4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine
SMILESCCCNC1COCC1CN1CCC(OC)C1
InChIInChI=1S/C13H26N2O2/c1-3-5-14-13-10-17-9-11(13)7-15-6-4-12(8-15)16-2/h11-14H,3-10H2,1-2H3
InChIKeyBMTJMLOPOZRKEY-UHFFFAOYSA-N
MW242.36 g/mol
LogP0.72
Rot. Bonds6

About 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine

4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine (PubChem CID 103534665) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine.

Molecular Properties

Compound Name4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine
PubChem CID103534665
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC Name4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine
SMILESCCCNC1COCC1CN1CCC(OC)C1
InChIInChI=1S/C13H26N2O2/c1-3-5-14-13-10-17-9-11(13)7-15-6-4-12(8-15)16-2/h11-14H,3-10H2,1-2H3
InChIKeyBMTJMLOPOZRKEY-UHFFFAOYSA-N
XLogP0.72
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-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-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-ylmethyl)-N-propyloxolan-3-amine
CID 113335831
4-(8-oxa-3-azabicyclo[3.2.1]octan-3-ylmethyl)-N-propyloxolan-3-amine
CID 66371661
N-propyl-4-[(4-propylazepan-1-yl)methyl]oxolan-3-amine
CID 66255259
2-[(4-methoxypiperidin-1-yl)methyl]-4-methyl-N-propylcyclohexan-1-amine
CID 62615391
4-[(3,4-dimethoxypyrrolidin-1-yl)methyl]-N-ethyloxolan-3-amine
CID 103534971
1-[[4-(ethylamino)oxolan-3-yl]methyl]-N,N-dimethylpyrrolidin-3-amine
CID 66259336
4-[(2-methylpiperidin-1-yl)methyl]-N-propyloxolan-3-amine
CID 66256953
3-(3-methoxypyrrolidin-1-yl)-N-propyloxan-4-amine
CID 103532098
N-propyl-3-[[3-(trifluoromethyl)piperidin-1-yl]methyl]oxan-4-amine
CID 103060409
N,N-dimethyl-1-[[4-(propylamino)oxan-3-yl]methyl]piperidin-4-amine
CID 103058865
2-[(3-methoxypyrrolidin-1-yl)methyl]-N-methylcyclohexan-1-amine
CID 103538860
4-[[3-(methoxymethyl)pyrrolidin-1-yl]methyl]-N-methyloxolan-3-amine
CID 66245194

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine?
The IUPAC name of 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine (CID 103534665) is 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine.
What is the SMILES notation for 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine?
The canonical SMILES for 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine is CCCNC1COCC1CN1CCC(OC)C1.
What is the InChIKey of 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine?
The InChIKey is BMTJMLOPOZRKEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-3-5-14-13-10-17-9-11(13)7-15-6-4-12(8-15)16-2/h11-14H,3-10H2,1-2H3.
What are the key properties of 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine?
4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine has a molecular weight of 242.36 g/mol, XLogP of 0.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methoxypyrrolidin-1-yl)methyl]-N-propyloxolan-3-amine is sourced from PubChem (CID 103534665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).