4-methoxy-N,N,1-trimethylpyrrolidin-3-amine

C8H18N2O — CID 163270635

IUPAC4-methoxy-N,N,1-trimethylpyrrolidin-3-amine
SMILESCOC1CN(C)CC1N(C)C
InChIInChI=1S/C8H18N2O/c1-9(2)7-5-10(3)6-8(7)11-4/h7-8H,5-6H2,1-4H3
InChIKeyATLPFIMMRMJINN-UHFFFAOYSA-N
MW158.24 g/mol
LogP-0.12
Rot. Bonds2

About 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine

4-methoxy-N,N,1-trimethylpyrrolidin-3-amine (PubChem CID 163270635) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine.

Molecular Properties

Compound Name4-methoxy-N,N,1-trimethylpyrrolidin-3-amine
PubChem CID163270635
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Name4-methoxy-N,N,1-trimethylpyrrolidin-3-amine
SMILESCOC1CN(C)CC1N(C)C
InChIInChI=1S/C8H18N2O/c1-9(2)7-5-10(3)6-8(7)11-4/h7-8H,5-6H2,1-4H3
InChIKeyATLPFIMMRMJINN-UHFFFAOYSA-N
XLogP-0.12
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 5-0.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 4-methoxy-N,N,1-trimethylpyrrolidin-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

(3R,4R)-3,4-dimethoxy-1-methylpyrrolidine
CID 59319954
(3S,4S)-3-methoxy-1,4-dimethylpyrrolidine
CID 139364384
S-(4-methoxy-1-methylpyrrolidin-3-yl)thiohydroxylamine
CID 166854812
(3R,4R)-4-methoxy-1-methylpyrrolidin-3-amine;dihydrochloride
CID 112756853
(3R,4R)-4-methoxy-N,1-dimethylpyrrolidin-3-amine
CID 89161776
trans-(1S,2S)-2-methoxy-N,N-dimethylcyclopentan-1-amine
CID 129113118
ethane;(4-methoxy-1-methylpyrrolidin-3-yl)methanol
CID 164904424
4-methoxy-1-methylpyrrolidine-3-sulfonamide
CID 137403318
(3R,4R)-4-methoxy-1-methyl-N-propan-2-ylpyrrolidin-3-amine
CID 122696201
(3S,4R)-N-ethyl-4-methoxy-1-methylpyrrolidin-3-amine
CID 122696200
ethane;N,N,1-trimethylazetidin-3-amine
CID 145389782
ethyl 4-(dimethylamino)-3-methoxypiperidine-1-carboxylate
CID 58035265

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine?
The IUPAC name of 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine (CID 163270635) is 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine.
What is the SMILES notation for 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine?
The canonical SMILES for 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine is COC1CN(C)CC1N(C)C.
What is the InChIKey of 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine?
The InChIKey is ATLPFIMMRMJINN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O/c1-9(2)7-5-10(3)6-8(7)11-4/h7-8H,5-6H2,1-4H3.
What are the key properties of 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine?
4-methoxy-N,N,1-trimethylpyrrolidin-3-amine has a molecular weight of 158.24 g/mol, XLogP of -0.12, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N,N,1-trimethylpyrrolidin-3-amine is sourced from PubChem (CID 163270635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).