N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine

C12H26N2 — CID 63157698

IUPACN,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine
SMILESCC1CCC(N(C)C(C)C(C)C)CN1
InChIInChI=1S/C12H26N2/c1-9(2)11(4)14(5)12-7-6-10(3)13-8-12/h9-13H,6-8H2,1-5H3
InChIKeyYNWKDAIGQLSUAV-UHFFFAOYSA-N
MW198.35 g/mol
LogP2.10
Rot. Bonds3

About N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine

N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine (PubChem CID 63157698) has the molecular formula C12H26N2 and a molecular weight of 198.35 g/mol. Its IUPAC name is N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine.

Molecular Properties

Compound NameN,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine
PubChem CID63157698
Molecular FormulaC12H26N2
Molecular Weight198.35 g/mol
Exact Mass198.21
IUPAC NameN,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine
SMILESCC1CCC(N(C)C(C)C(C)C)CN1
InChIInChI=1S/C12H26N2/c1-9(2)11(4)14(5)12-7-6-10(3)13-8-12/h9-13H,6-8H2,1-5H3
InChIKeyYNWKDAIGQLSUAV-UHFFFAOYSA-N
XLogP2.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine?
The IUPAC name of N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine (CID 63157698) is N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine.
What is the SMILES notation for N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine?
The canonical SMILES for N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine is CC1CCC(N(C)C(C)C(C)C)CN1.
What is the InChIKey of N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine?
The InChIKey is YNWKDAIGQLSUAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2/c1-9(2)11(4)14(5)12-7-6-10(3)13-8-12/h9-13H,6-8H2,1-5H3.
What are the key properties of N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine?
N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine has a molecular weight of 198.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-dimethyl-N-(3-methylbutan-2-yl)piperidin-3-amine is sourced from PubChem (CID 63157698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).