1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine

C17H34N2 — CID 115720105

IUPAC1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine
SMILESCC1CCC(C(C)C)C(NC2CCN(C)CC2C)C1
InChIInChI=1S/C17H34N2/c1-12(2)15-7-6-13(3)10-17(15)18-16-8-9-19(5)11-14(16)4/h12-18H,6-11H2,1-5H3
InChIKeyQGSFXJICNNOJHP-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.38
Rot. Bonds3

About 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine

1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine (PubChem CID 115720105) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine.

Molecular Properties

Compound Name1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine
PubChem CID115720105
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine
SMILESCC1CCC(C(C)C)C(NC2CCN(C)CC2C)C1
InChIInChI=1S/C17H34N2/c1-12(2)15-7-6-13(3)10-17(15)18-16-8-9-19(5)11-14(16)4/h12-18H,6-11H2,1-5H3
InChIKeyQGSFXJICNNOJHP-UHFFFAOYSA-N
XLogP3.38
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine?
The IUPAC name of 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine (CID 115720105) is 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine.
What is the SMILES notation for 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine?
The canonical SMILES for 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine is CC1CCC(C(C)C)C(NC2CCN(C)CC2C)C1.
What is the InChIKey of 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine?
The InChIKey is QGSFXJICNNOJHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-12(2)15-7-6-13(3)10-17(15)18-16-8-9-19(5)11-14(16)4/h12-18H,6-11H2,1-5H3.
What are the key properties of 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine?
1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine has a molecular weight of 266.47 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidin-4-amine is sourced from PubChem (CID 115720105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).