1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine

C12H26N2 — CID 115920386

IUPAC1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine
SMILESCCC(C)(CC)NC1CCN(C)CC1
InChIInChI=1S/C12H26N2/c1-5-12(3,6-2)13-11-7-9-14(4)10-8-11/h11,13H,5-10H2,1-4H3
InChIKeyQDRBWHVGCHCCGC-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.25
Rot. Bonds4

About 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine

1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine (PubChem CID 115920386) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine.

Molecular Properties

Compound Name1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine
PubChem CID115920386
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine
SMILESCCC(C)(CC)NC1CCN(C)CC1
InChIInChI=1S/C12H26N2/c1-5-12(3,6-2)13-11-7-9-14(4)10-8-11/h11,13H,5-10H2,1-4H3
InChIKeyQDRBWHVGCHCCGC-UHFFFAOYSA-N
XLogP2.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-N-(3-methylnonan-3-yl)piperidin-4-amine
CID 129254171
2-ethyl-2-[(1-methylpiperidin-4-yl)amino]propane-1,3-diol
CID 115927628
2-(dimethylamino)-1-[4-(3-methylpentan-3-ylamino)piperidin-1-yl]ethanone
CID 130426463
2-(cyclopropylamino)-2-methyl-4-[methyl-(1-methylpiperidin-4-yl)amino]pentan-1-ol
CID 64798033
N-(3-methylpentan-3-yl)-1,1-dioxothiolan-3-amine
CID 103829133
N-(1-chloro-2-methylbutan-2-yl)cyclohexanamine
CID 82937345
N-(3,3-dimethylbutyl)-1-methylpiperidin-4-amine
CID 60693743
1-methyl-4-[(3S)-2,2,4-trimethylpentan-3-yl]piperidine
CID 139460422
2-methyl-2-[(1-methylpyrrolidin-3-yl)amino]butanoic acid
CID 82238992
2-(cyclopropylamino)-2-methyl-5-[methyl-[(1-methylpyrrolidin-3-yl)methyl]amino]pentan-1-ol
CID 64788794
N-(3,3-difluorobutan-2-yl)-1-methylpiperidin-4-amine
CID 131048505
N-tert-butyl-1-methylpyrrolidin-3-amine;ethane
CID 167501392

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine?
The IUPAC name of 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine (CID 115920386) is 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine.
What is the SMILES notation for 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine?
The canonical SMILES for 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine is CCC(C)(CC)NC1CCN(C)CC1.
What is the InChIKey of 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine?
The InChIKey is QDRBWHVGCHCCGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-5-12(3,6-2)13-11-7-9-14(4)10-8-11/h11,13H,5-10H2,1-4H3.
What are the key properties of 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine?
1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine has a molecular weight of 198.35 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(3-methylpentan-3-yl)piperidin-4-amine is sourced from PubChem (CID 115920386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).