1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine

C13H28N2 — CID 62089869

IUPAC1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine
SMILESCNC(C)CN1CCC(C(C)(C)C)CC1
InChIInChI=1S/C13H28N2/c1-11(14-5)10-15-8-6-12(7-9-15)13(2,3)4/h11-12,14H,6-10H2,1-5H3
InChIKeyLTBJNBWXYTZCFO-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds3

About 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine

1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine (PubChem CID 62089869) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine
PubChem CID62089869
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine
SMILESCNC(C)CN1CCC(C(C)(C)C)CC1
InChIInChI=1S/C13H28N2/c1-11(14-5)10-15-8-6-12(7-9-15)13(2,3)4/h11-12,14H,6-10H2,1-5H3
InChIKeyLTBJNBWXYTZCFO-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-tert-butyl-3-(4-tert-butylpiperidin-1-yl)-2-methylpropan-1-amine
CID 55070199
3-(4-tert-butylpiperidin-1-yl)-2-(methylamino)propanenitrile
CID 62090564
4-(4-tert-butylpiperidin-1-yl)-N,3,3-trimethylbutan-2-amine
CID 66452767
4-tert-butyl-N-(1-pyrrolidin-1-ylpropan-2-yl)cyclohexan-1-amine
CID 61223216
methyl 3-(4-tert-butylpiperidin-1-yl)-2-(propan-2-ylamino)propanoate
CID 62091822
4-(4-tert-butylazepan-1-yl)-3-(methylamino)butan-1-ol
CID 64899056
1-(4-tert-butylpiperidin-1-yl)pentan-2-amine
CID 62089164
1-(4-tert-butylpiperidin-1-yl)pentan-2-ol
CID 62090229
(4-tert-butylpiperidin-1-yl)methylphosphane
CID 131973586
N-[2-(4-tert-butylpiperidin-1-yl)ethyl]-3-methylbutan-2-amine
CID 55089717
methyl 3-(4-tert-butylpiperidin-1-yl)-2-(propylamino)propanoate
CID 62089886
1-(3-tert-butylpyrrolidin-1-yl)-3-methoxy-N-methylpropan-2-amine
CID 107505934

Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine?
The IUPAC name of 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine (CID 62089869) is 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine.
What is the SMILES notation for 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine?
The canonical SMILES for 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine is CNC(C)CN1CCC(C(C)(C)C)CC1.
What is the InChIKey of 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine?
The InChIKey is LTBJNBWXYTZCFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-11(14-5)10-15-8-6-12(7-9-15)13(2,3)4/h11-12,14H,6-10H2,1-5H3.
What are the key properties of 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine?
1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine has a molecular weight of 212.38 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylpiperidin-1-yl)-N-methylpropan-2-amine is sourced from PubChem (CID 62089869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).