3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine

C11H22N2 — CID 80561901

IUPAC3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine
SMILESCC1CCC(C)N(C2CC(N)C2)C1
InChIInChI=1S/C11H22N2/c1-8-3-4-9(2)13(7-8)11-5-10(12)6-11/h8-11H,3-7,12H2,1-2H3
InChIKeyUGKZXUBEFICHCO-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.60
Rot. Bonds1

About 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine

3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine (PubChem CID 80561901) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine
PubChem CID80561901
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine
SMILESCC1CCC(C)N(C2CC(N)C2)C1
InChIInChI=1S/C11H22N2/c1-8-3-4-9(2)13(7-8)11-5-10(12)6-11/h8-11H,3-7,12H2,1-2H3
InChIKeyUGKZXUBEFICHCO-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-Methylpropyl)piperidin-4-amine
CID 550780
N-(cyclohexylmethyl)-1-ethylpiperidin-4-amine
CID 2846481
4-Amino-1,2,2,6,6-pentamethylpiperidine
CID 693792
1-(1-Isopropyl-3-piperidinyl)methanamine
CID 3157476
3-(3,5-Dimethylpiperidin-1-yl)propan-1-amine
CID 6487611
(1-Methylpiperidin-3-yl)methanamine
CID 13675353
1,3-Dimethylpiperidin-4-amine
CID 23008883
2-[1-(2-Methylpropyl)piperidin-2-yl]ethan-1-amine
CID 45791072
1,3,3-Trimethylpiperidin-4-amine
CID 68271528
3-(3-Methylpiperidin-1-yl)propan-1-amine
CID 33069
2-(1-Methylpiperidin-3-yl)ethan-1-amine
CID 12253960
1-(1-Methylpiperidin-4-yl)ethan-1-amine
CID 21057734

Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine?
The IUPAC name of 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine (CID 80561901) is 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine.
What is the SMILES notation for 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine?
The canonical SMILES for 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine is CC1CCC(C)N(C2CC(N)C2)C1.
What is the InChIKey of 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine?
The InChIKey is UGKZXUBEFICHCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-8-3-4-9(2)13(7-8)11-5-10(12)6-11/h8-11H,3-7,12H2,1-2H3.
What are the key properties of 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine?
3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethylpiperidin-1-yl)cyclobutan-1-amine is sourced from PubChem (CID 80561901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).