[(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine

C8H18N2 — CID 124835848

IUPAC[(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine
SMILESC[C@H]1CCCN(C)[C@H]1CN
InChIInChI=1S/C8H18N2/c1-7-4-3-5-10(2)8(7)6-9/h7-8H,3-6,9H2,1-2H3/t7-,8-/m0/s1
InChIKeyVQBDQIDHPIIYCS-YUMQZZPRSA-N
MW142.25 g/mol
LogP0.68
Rot. Bonds1

About [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine

[(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine (PubChem CID 124835848) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine.

Molecular Properties

Compound Name[(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine
PubChem CID124835848
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name[(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine
SMILESC[C@H]1CCCN(C)[C@H]1CN
InChIInChI=1S/C8H18N2/c1-7-4-3-5-10(2)8(7)6-9/h7-8H,3-6,9H2,1-2H3/t7-,8-/m0/s1
InChIKeyVQBDQIDHPIIYCS-YUMQZZPRSA-N
XLogP0.68
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1,3-dimethylpyrrolidin-2-yl)methanamine
CID 58841122
(1-cyclopropyl-3-methylpiperidin-2-yl)methanamine
CID 103439574
2-butyl-1,3-dimethylpiperidine
CID 145095316
[1-(azetidin-3-yl)-3-methylpiperidin-2-yl]methanamine
CID 130622217
[(2R,3R)-2-ethyl-1-methylpiperidin-3-yl]methanamine
CID 82416011
(1,2-dimethylpiperidin-3-yl)methanamine
CID 83669908
2-[2-(aminomethyl)-3-methylpiperidin-1-yl]propan-1-ol
CID 130503327
[1-(5,6-dimethyl-1,2,4-triazin-3-yl)-3-methylpiperidin-2-yl]methanamine
CID 114787115
[(2S,3S)-2-(aminomethyl)-3-methylpiperidin-1-yl]-(1-methylpiperidin-4-yl)methanone
CID 124592788
[2-(aminomethyl)-3-methylpiperidin-1-yl]-(1-methylpiperidin-4-yl)methanone
CID 119597339
[3-methyl-1-(3-phenoxypropyl)piperidin-2-yl]methanamine
CID 62935912
[1-(3-chloroprop-2-enyl)-3-methylpiperidin-2-yl]methanamine
CID 77015374

Frequently Asked Questions

What is the IUPAC name of [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine?
The IUPAC name of [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine (CID 124835848) is [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine.
What is the SMILES notation for [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine?
The canonical SMILES for [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine is C[C@H]1CCCN(C)[C@H]1CN.
What is the InChIKey of [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine?
The InChIKey is VQBDQIDHPIIYCS-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H18N2/c1-7-4-3-5-10(2)8(7)6-9/h7-8H,3-6,9H2,1-2H3/t7-,8-/m0/s1.
What are the key properties of [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine?
[(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine has a molecular weight of 142.25 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R,3S)-1,3-dimethylpiperidin-2-yl]methanamine is sourced from PubChem (CID 124835848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).