[1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine

C11H22N2 — CID 106661002

IUPAC[1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine
SMILESCC1CC(C)CN(C2(CN)CC2)C1
InChIInChI=1S/C11H22N2/c1-9-5-10(2)7-13(6-9)11(8-12)3-4-11/h9-10H,3-8,12H2,1-2H3
InChIKeyIKDTVQZDMVFCGD-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.46
Rot. Bonds2

About [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine

[1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine (PubChem CID 106661002) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine.

Molecular Properties

Compound Name[1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine
PubChem CID106661002
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name[1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine
SMILESCC1CC(C)CN(C2(CN)CC2)C1
InChIInChI=1S/C11H22N2/c1-9-5-10(2)7-13(6-9)11(8-12)3-4-11/h9-10H,3-8,12H2,1-2H3
InChIKeyIKDTVQZDMVFCGD-UHFFFAOYSA-N
XLogP1.46
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 ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine?
The IUPAC name of [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine (CID 106661002) is [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine.
What is the SMILES notation for [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine?
The canonical SMILES for [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine is CC1CC(C)CN(C2(CN)CC2)C1.
What is the InChIKey of [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine?
The InChIKey is IKDTVQZDMVFCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9-5-10(2)7-13(6-9)11(8-12)3-4-11/h9-10H,3-8,12H2,1-2H3.
What are the key properties of [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine?
[1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine has a molecular weight of 182.31 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,5-dimethylpiperidin-1-yl)cyclopropyl]methanamine is sourced from PubChem (CID 106661002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).