2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine

C9H20N2 — CID 97002391

IUPAC2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine
SMILESC[C@@H]1CC[C@@H](C)N(CCN)C1
InChIInChI=1S/C9H20N2/c1-8-3-4-9(2)11(7-8)6-5-10/h8-9H,3-7,10H2,1-2H3/t8-,9-/m1/s1
InChIKeyJBLDWYZIFBZKGQ-RKDXNWHRSA-N
MW156.27 g/mol
LogP1.07
Rot. Bonds2

About 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine

2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine (PubChem CID 97002391) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine
PubChem CID97002391
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine
SMILESC[C@@H]1CC[C@@H](C)N(CCN)C1
InChIInChI=1S/C9H20N2/c1-8-3-4-9(2)11(7-8)6-5-10/h8-9H,3-7,10H2,1-2H3/t8-,9-/m1/s1
InChIKeyJBLDWYZIFBZKGQ-RKDXNWHRSA-N
XLogP1.07
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine 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

Methyl(2-(4-methylpiperidin-1-yl)ethyl)amine
CID 43199381
2-(3,5-Dimethylpiperidin-1-yl)ethan-1-amine
CID 6484177
3-amino-N-ethylpiperidine
CID 98094
1-(2-Methylpropyl)piperidin-4-amine
CID 550780
1-(4-Methyl-cyclohexyl)-piperazinehydrochloride
CID 16188159
1-(1-Isopropyl-3-piperidinyl)methanamine
CID 3157476
3-(3,5-Dimethylpiperidin-1-yl)propan-1-amine
CID 6487611
(1-Methylpiperidin-2-yl)methanamine
CID 2794677
1,3-Dimethylpiperidin-4-amine
CID 23008883
2-[1-(2-Methylpropyl)piperidin-2-yl]ethan-1-amine
CID 45791072
3-(3-Methylpiperidin-1-yl)propan-1-amine
CID 33069
N-(2-Piperidylmethyl)-dimethylamine
CID 252484

Frequently Asked Questions

What is the IUPAC name of 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine?
The IUPAC name of 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine (CID 97002391) is 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine.
What is the SMILES notation for 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine?
The canonical SMILES for 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine is C[C@@H]1CC[C@@H](C)N(CCN)C1.
What is the InChIKey of 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine?
The InChIKey is JBLDWYZIFBZKGQ-RKDXNWHRSA-N. The full InChI is InChI=1S/C9H20N2/c1-8-3-4-9(2)11(7-8)6-5-10/h8-9H,3-7,10H2,1-2H3/t8-,9-/m1/s1.
What are the key properties of 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine?
2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine has a molecular weight of 156.27 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R,5R)-2,5-dimethylpiperidin-1-yl]ethanamine is sourced from PubChem (CID 97002391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).