1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine

C14H30N2O — CID 64583577

IUPAC1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine
SMILESCNC(CCN1CCC(COC)C1)C(C)(C)C
InChIInChI=1S/C14H30N2O/c1-14(2,3)13(15-4)7-9-16-8-6-12(10-16)11-17-5/h12-13,15H,6-11H2,1-5H3
InChIKeyUEPZXNZQNQKTAP-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.98
Rot. Bonds6

About 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine

1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine (PubChem CID 64583577) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine.

Molecular Properties

Compound Name1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine
PubChem CID64583577
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine
SMILESCNC(CCN1CCC(COC)C1)C(C)(C)C
InChIInChI=1S/C14H30N2O/c1-14(2,3)13(15-4)7-9-16-8-6-12(10-16)11-17-5/h12-13,15H,6-11H2,1-5H3
InChIKeyUEPZXNZQNQKTAP-UHFFFAOYSA-N
XLogP1.98
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-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

1-[4-(methoxymethyl)piperidin-1-yl]-N,3,3-trimethylbutan-2-amine
CID 63973269
4-[3-(methoxymethyl)pyrrolidin-1-yl]-N-methylbutan-2-amine
CID 64568719
1-[3-(methoxymethyl)pyrrolidin-1-yl]-4,4-dimethylpentan-3-ol
CID 64581992
1-[4,4-dimethyl-3-(methylamino)pentyl]piperidin-4-ol
CID 62625302
N-[3-[3-(methoxymethyl)pyrrolidin-1-yl]propyl]-2-methylpropan-2-amine
CID 64568140
1-(2-iodoethyl)-3-(methoxymethyl)pyrrolidine
CID 131222845
N,4,4-trimethyl-1-piperidin-1-ylpentan-3-amine
CID 62623158
(3S)-3-(methoxymethyl)-1-(2-methylpropyl)pyrrolidine
CID 89358409
N-[3-[3-(methoxymethyl)pyrrolidin-1-yl]propyl]-2-methylpropan-1-amine
CID 64570291
N,4,4-trimethyl-1-(3-propoxypiperidin-1-yl)pentan-3-amine
CID 55098092
7-[3-(methoxymethyl)pyrrolidin-1-yl]heptan-1-amine
CID 64599167
1-[2-(bromomethyl)-3,3-dimethylbutyl]-3-(methoxymethyl)pyrrolidine
CID 65015225

Frequently Asked Questions

What is the IUPAC name of 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine?
The IUPAC name of 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine (CID 64583577) is 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine.
What is the SMILES notation for 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine?
The canonical SMILES for 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine is CNC(CCN1CCC(COC)C1)C(C)(C)C.
What is the InChIKey of 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine?
The InChIKey is UEPZXNZQNQKTAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-14(2,3)13(15-4)7-9-16-8-6-12(10-16)11-17-5/h12-13,15H,6-11H2,1-5H3.
What are the key properties of 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine?
1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine has a molecular weight of 242.41 g/mol, XLogP of 1.98, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(methoxymethyl)pyrrolidin-1-yl]-N,4,4-trimethylpentan-3-amine is sourced from PubChem (CID 64583577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).