3-(cyclobutylmethyl)-1-methylpiperidin-3-amine

C11H22N2 — CID 84658746

IUPAC3-(cyclobutylmethyl)-1-methylpiperidin-3-amine
SMILESCN1CCCC(N)(CC2CCC2)C1
InChIInChI=1S/C11H22N2/c1-13-7-3-6-11(12,9-13)8-10-4-2-5-10/h10H,2-9,12H2,1H3
InChIKeyIXTXFRSHUXXISL-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.60
Rot. Bonds2

About 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine

3-(cyclobutylmethyl)-1-methylpiperidin-3-amine (PubChem CID 84658746) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine.

Molecular Properties

Compound Name3-(cyclobutylmethyl)-1-methylpiperidin-3-amine
PubChem CID84658746
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name3-(cyclobutylmethyl)-1-methylpiperidin-3-amine
SMILESCN1CCCC(N)(CC2CCC2)C1
InChIInChI=1S/C11H22N2/c1-13-7-3-6-11(12,9-13)8-10-4-2-5-10/h10H,2-9,12H2,1H3
InChIKeyIXTXFRSHUXXISL-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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

3-(fluoromethyl)-1-methylpiperidin-3-amine
CID 84762965
1-[(1-methylpiperidin-4-yl)methyl]cyclopentan-1-amine
CID 115074013
1-[(1-methylpiperidin-4-yl)methyl]cyclohexan-1-amine
CID 115074068
2-(3-amino-1-methylpiperidin-3-yl)acetamide
CID 83682898
1-methyl-3-(2-pyrrolidin-1-ylethyl)piperidin-3-amine
CID 84734630
2-(3-amino-1-methylpiperidin-3-yl)acetate
CID 86649846
1-(cycloheptylmethyl)cyclopropan-1-amine
CID 83682636
3-(cyclopropylmethyl)-1-methylpyrrolidin-3-ol
CID 59504968
(3-cyclopropyl-1-methylpiperidin-3-yl)methanamine
CID 83816076
2-(4-amino-1-methylazepan-4-yl)acetamide
CID 83846985
1-[2-[methyl-[(1-methylpiperidin-4-yl)methyl]amino]ethyl]cyclopentan-1-amine
CID 64681854
methyl 2-(3-amino-1-methylazepan-3-yl)acetate
CID 83908328

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine?
The IUPAC name of 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine (CID 84658746) is 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine.
What is the SMILES notation for 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine?
The canonical SMILES for 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine is CN1CCCC(N)(CC2CCC2)C1.
What is the InChIKey of 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine?
The InChIKey is IXTXFRSHUXXISL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-13-7-3-6-11(12,9-13)8-10-4-2-5-10/h10H,2-9,12H2,1H3.
What are the key properties of 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine?
3-(cyclobutylmethyl)-1-methylpiperidin-3-amine has a molecular weight of 182.31 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethyl)-1-methylpiperidin-3-amine is sourced from PubChem (CID 84658746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).