N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine

C11H24N2 — CID 62536720

IUPACN-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine
SMILESCNC1CCCN(C(C)C(C)C)C1
InChIInChI=1S/C11H24N2/c1-9(2)10(3)13-7-5-6-11(8-13)12-4/h9-12H,5-8H2,1-4H3
InChIKeyPQFXNMVYWRCPIF-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.71
Rot. Bonds3

About N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine

N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine (PubChem CID 62536720) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine
PubChem CID62536720
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine
SMILESCNC1CCCN(C(C)C(C)C)C1
InChIInChI=1S/C11H24N2/c1-9(2)10(3)13-7-5-6-11(8-13)12-4/h9-12H,5-8H2,1-4H3
InChIKeyPQFXNMVYWRCPIF-UHFFFAOYSA-N
XLogP1.71
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine?
The IUPAC name of N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine (CID 62536720) is N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine.
What is the SMILES notation for N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine?
The canonical SMILES for N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine is CNC1CCCN(C(C)C(C)C)C1.
What is the InChIKey of N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine?
The InChIKey is PQFXNMVYWRCPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-9(2)10(3)13-7-5-6-11(8-13)12-4/h9-12H,5-8H2,1-4H3.
What are the key properties of N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine?
N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine has a molecular weight of 184.33 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(3-methylbutan-2-yl)piperidin-3-amine is sourced from PubChem (CID 62536720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).