[6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine

C12H26N2 — CID 62105869

IUPAC[6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine
SMILESCCC(C)CN1CC(CN)CCC1C
InChIInChI=1S/C12H26N2/c1-4-10(2)8-14-9-12(7-13)6-5-11(14)3/h10-12H,4-9,13H2,1-3H3
InChIKeyYXNRMQGWNLIHNN-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.09
Rot. Bonds4

About [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine

[6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine (PubChem CID 62105869) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine.

Molecular Properties

Compound Name[6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine
PubChem CID62105869
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name[6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine
SMILESCCC(C)CN1CC(CN)CCC1C
InChIInChI=1S/C12H26N2/c1-4-10(2)8-14-9-12(7-13)6-5-11(14)3/h10-12H,4-9,13H2,1-3H3
InChIKeyYXNRMQGWNLIHNN-UHFFFAOYSA-N
XLogP2.09
TPSA29.26 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 ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine 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

[4-(2-methylbutyl)cyclohexyl]methanamine
CID 130208059
(6-methyl-1-octylpiperidin-3-yl)methanamine
CID 55211233
[4-methyl-1-(2-methylbutyl)piperazin-2-yl]methanamine
CID 80504638
[3-methyl-1-(2-methylbutyl)pyrrolidin-2-yl]methanamine
CID 102784417
2-methyl-3-(2-methylaziridin-1-yl)propan-1-amine
CID 59479573
[6-methyl-1-[(4-propan-2-ylphenyl)methyl]piperidin-3-yl]methanamine
CID 54989394
[6-methyl-1-(oxan-4-ylmethyl)piperidin-3-yl]methanamine
CID 62387329
1-[(2S,5S)-5-(aminomethyl)-2-methylpiperidin-1-yl]-2-methylpropan-1-one
CID 174081766
(2S,4S)-2,4-dimethyl-1-(2-methylbutyl)piperidine
CID 130645010
5-[[5-(aminomethyl)-2-methylpiperidin-1-yl]methyl]pyrrolidin-2-one
CID 107530511
2-[5-(aminomethyl)-2-methylpiperidin-1-yl]-1-(3-methoxyphenyl)ethanol
CID 81134628
(2R)-1-(aminodiazenyl)-3-(5-ethyl-2-methylpiperidin-1-yl)propan-2-ol
CID 143050182

Frequently Asked Questions

What is the IUPAC name of [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine?
The IUPAC name of [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine (CID 62105869) is [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine.
What is the SMILES notation for [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine?
The canonical SMILES for [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine is CCC(C)CN1CC(CN)CCC1C.
What is the InChIKey of [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine?
The InChIKey is YXNRMQGWNLIHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-4-10(2)8-14-9-12(7-13)6-5-11(14)3/h10-12H,4-9,13H2,1-3H3.
What are the key properties of [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine?
[6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine has a molecular weight of 198.35 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methyl-1-(2-methylbutyl)piperidin-3-yl]methanamine is sourced from PubChem (CID 62105869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).