4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine

C12H26N2 — CID 64707838

IUPAC4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine
SMILESCC(N)CC(C)N1CCCC(C)C1C
InChIInChI=1S/C12H26N2/c1-9-6-5-7-14(12(9)4)11(3)8-10(2)13/h9-12H,5-8,13H2,1-4H3
InChIKeyNGXLSYSQAJAEFA-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.23
Rot. Bonds3

About 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine

4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine (PubChem CID 64707838) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine.

Molecular Properties

Compound Name4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine
PubChem CID64707838
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC Name4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine
SMILESCC(N)CC(C)N1CCCC(C)C1C
InChIInChI=1S/C12H26N2/c1-9-6-5-7-14(12(9)4)11(3)8-10(2)13/h9-12H,5-8,13H2,1-4H3
InChIKeyNGXLSYSQAJAEFA-UHFFFAOYSA-N
XLogP2.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,3-dimethylpiperidin-1-yl)-N-ethylpentan-2-amine
CID 64707637
N-tert-butyl-3-(2,3-dimethylpiperidin-1-yl)butan-1-amine
CID 62413689
2-cyclopropyl-2-(2,3-dimethylpiperidin-1-yl)ethanamine
CID 62124066
4-(3-methyl-1,4-oxazepan-4-yl)pentan-2-amine
CID 130952021
1-butan-2-yl-3-ethyl-2-methylpiperidine
CID 123374996
4-(2,4-dimethylpiperidin-1-yl)pentan-2-amine
CID 64708883
3-amino-2-(2,3-dimethylpiperidin-1-yl)hexan-1-ol
CID 114357088
2-(2,3-dimethylpiperidin-1-yl)-1-(4-methylphenyl)propan-1-amine
CID 62125335
(2R)-2-amino-1-(2,3-dimethylpiperidin-1-yl)-4-methylpentan-1-one
CID 104903392
3-(2,3-dimethylpiperidin-1-yl)pentanethioamide
CID 62122843
2-[2-(aminomethyl)-3-methylpiperidin-1-yl]propan-1-ol
CID 130503327
1-(2,3-dimethylpiperidin-1-yl)-1-(2-methoxyphenyl)butan-2-amine
CID 62124586

Frequently Asked Questions

What is the IUPAC name of 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine?
The IUPAC name of 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine (CID 64707838) is 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine.
What is the SMILES notation for 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine?
The canonical SMILES for 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine is CC(N)CC(C)N1CCCC(C)C1C.
What is the InChIKey of 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine?
The InChIKey is NGXLSYSQAJAEFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-9-6-5-7-14(12(9)4)11(3)8-10(2)13/h9-12H,5-8,13H2,1-4H3.
What are the key properties of 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine?
4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine has a molecular weight of 198.35 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,3-dimethylpiperidin-1-yl)pentan-2-amine is sourced from PubChem (CID 64707838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).