N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine

C12H26N2O — CID 106675409

IUPACN-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine
SMILESCOC(C)(C)CCNC1CCCN(C)C1
InChIInChI=1S/C12H26N2O/c1-12(2,15-4)7-8-13-11-6-5-9-14(3)10-11/h11,13H,5-10H2,1-4H3
InChIKeyLTKULMGLVXXRKW-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.49
Rot. Bonds5

About N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine

N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine (PubChem CID 106675409) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine.

Molecular Properties

Compound NameN-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine
PubChem CID106675409
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine
SMILESCOC(C)(C)CCNC1CCCN(C)C1
InChIInChI=1S/C12H26N2O/c1-12(2,15-4)7-8-13-11-6-5-9-14(3)10-11/h11,13H,5-10H2,1-4H3
InChIKeyLTKULMGLVXXRKW-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-chloroethyl)-1-methylpiperidin-3-amine
CID 115214671
N-(3-methoxy-3-methylbutyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-7-amine
CID 103033505
1-cyclopropyl-N-(3-methoxy-3-methylbutyl)piperidin-4-amine
CID 106675336
N-methyl-N'-(1-methylpiperidin-3-yl)propane-1,3-diamine
CID 115197757
2,2-dimethyl-N-(1-methylpiperidin-3-yl)butane-1,4-diamine
CID 115204269
tert-butyl 3-[(3-methoxy-3-methylbutyl)amino]azepane-1-carboxylate
CID 107249434
1-methyl-N-[(1-methylpiperidin-4-yl)methyl]piperidin-3-amine
CID 62657172
4-chloro-N-(3-methoxy-3-methylbutyl)cyclohexan-1-amine
CID 103037173
2-methyl-N'-(1-methylpiperidin-3-yl)butane-1,4-diamine
CID 115203024
tert-butyl N-[2-methyl-1-[(1-methylpiperidin-3-yl)amino]propan-2-yl]carbamate
CID 104624574
4-[(1-methylpiperidin-3-yl)amino]butanenitrile
CID 115231510
1-methyl-N-(2-methylbutyl)piperidin-3-amine
CID 61211786

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine?
The IUPAC name of N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine (CID 106675409) is N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine.
What is the SMILES notation for N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine?
The canonical SMILES for N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine is COC(C)(C)CCNC1CCCN(C)C1.
What is the InChIKey of N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine?
The InChIKey is LTKULMGLVXXRKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-12(2,15-4)7-8-13-11-6-5-9-14(3)10-11/h11,13H,5-10H2,1-4H3.
What are the key properties of N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine?
N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine has a molecular weight of 214.35 g/mol, XLogP of 1.49, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-3-methylbutyl)-1-methylpiperidin-3-amine is sourced from PubChem (CID 106675409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).