4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine

C13H26N2 — CID 62807250

IUPAC4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine
SMILESCC1CC(C)CN(C2CCC(N)CC2)C1
InChIInChI=1S/C13H26N2/c1-10-7-11(2)9-15(8-10)13-5-3-12(14)4-6-13/h10-13H,3-9,14H2,1-2H3
InChIKeyDNAXEEVMEQWMET-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.23
Rot. Bonds1

About 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine

4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine (PubChem CID 62807250) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine
PubChem CID62807250
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC Name4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine
SMILESCC1CC(C)CN(C2CCC(N)CC2)C1
InChIInChI=1S/C13H26N2/c1-10-7-11(2)9-15(8-10)13-5-3-12(14)4-6-13/h10-13H,3-9,14H2,1-2H3
InChIKeyDNAXEEVMEQWMET-UHFFFAOYSA-N
XLogP2.23
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine?
The IUPAC name of 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine (CID 62807250) is 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine.
What is the SMILES notation for 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine?
The canonical SMILES for 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine is CC1CC(C)CN(C2CCC(N)CC2)C1.
What is the InChIKey of 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine?
The InChIKey is DNAXEEVMEQWMET-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-10-7-11(2)9-15(8-10)13-5-3-12(14)4-6-13/h10-13H,3-9,14H2,1-2H3.
What are the key properties of 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine?
4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine has a molecular weight of 210.36 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dimethylpiperidin-1-yl)cyclohexan-1-amine is sourced from PubChem (CID 62807250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).