3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine

C12H24N2O — CID 63219436

IUPAC3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine
SMILESCNC1CCOCC1N1CCCC1(C)C
InChIInChI=1S/C12H24N2O/c1-12(2)6-4-7-14(12)11-9-15-8-5-10(11)13-3/h10-11,13H,4-9H2,1-3H3
InChIKeyGJMAWCPQZVCRGP-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.24
Rot. Bonds2

About 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine

3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine (PubChem CID 63219436) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine.

Molecular Properties

Compound Name3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine
PubChem CID63219436
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine
SMILESCNC1CCOCC1N1CCCC1(C)C
InChIInChI=1S/C12H24N2O/c1-12(2)6-4-7-14(12)11-9-15-8-5-10(11)13-3/h10-11,13H,4-9H2,1-3H3
InChIKeyGJMAWCPQZVCRGP-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,2-dimethylpyrrolidin-1-yl)-N-methylcyclohexan-1-amine
CID 63219990
1-[2-(2,2-dimethylpyrrolidin-1-yl)cyclobutyl]-N-methylmethanamine
CID 80999102
N-methyl-3-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)oxan-4-amine
CID 66391896
1-[2-(2,2-dimethylpyrrolidin-1-yl)cyclopentyl]-N-methylmethanamine
CID 112546149
2-(2,2-dimethylpyrrolidin-1-yl)-N-ethylcycloheptan-1-amine
CID 55161540
2-(2,2-dimethylpyrrolidin-1-yl)cyclopentan-1-amine
CID 63220033
2-(2,2-dimethylpyrrolidin-1-yl)-N-methyl-1-(oxolan-3-yl)ethanamine
CID 104746222
(3S,4R)-4-(methylamino)oxan-3-ol
CID 68677504
2,2-dimethyl-N-(oxolan-3-yl)pyrrolidine-1-carboxamide
CID 115760684
3-(methylamino)oxan-4-ol
CID 55287171
5-(2,2-dimethylpyrrolidin-1-yl)-2,2-dimethyl-N-propylcyclopentan-1-amine
CID 79859592
tert-butyl N-[2-(2,2-dimethylpyrrolidin-1-yl)-4-hydroxycyclohexyl]carbamate
CID 165498320

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine?
The IUPAC name of 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine (CID 63219436) is 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine.
What is the SMILES notation for 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine?
The canonical SMILES for 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine is CNC1CCOCC1N1CCCC1(C)C.
What is the InChIKey of 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine?
The InChIKey is GJMAWCPQZVCRGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-12(2)6-4-7-14(12)11-9-15-8-5-10(11)13-3/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine?
3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine has a molecular weight of 212.34 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpyrrolidin-1-yl)-N-methyloxan-4-amine is sourced from PubChem (CID 63219436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).