2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine

C15H30N2 — CID 83199239

IUPAC2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine
SMILESC=CCN(CC(C)(C)C1CCCNC1)C(C)C
InChIInChI=1S/C15H30N2/c1-6-10-17(13(2)3)12-15(4,5)14-8-7-9-16-11-14/h6,13-14,16H,1,7-12H2,2-5H3
InChIKeyLQWHYDCNGFEHSG-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.91
Rot. Bonds6

About 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine

2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine (PubChem CID 83199239) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine.

Molecular Properties

Compound Name2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine
PubChem CID83199239
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine
SMILESC=CCN(CC(C)(C)C1CCCNC1)C(C)C
InChIInChI=1S/C15H30N2/c1-6-10-17(13(2)3)12-15(4,5)14-8-7-9-16-11-14/h6,13-14,16H,1,7-12H2,2-5H3
InChIKeyLQWHYDCNGFEHSG-UHFFFAOYSA-N
XLogP2.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine?
The IUPAC name of 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine (CID 83199239) is 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine.
What is the SMILES notation for 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine?
The canonical SMILES for 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine is C=CCN(CC(C)(C)C1CCCNC1)C(C)C.
What is the InChIKey of 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine?
The InChIKey is LQWHYDCNGFEHSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-6-10-17(13(2)3)12-15(4,5)14-8-7-9-16-11-14/h6,13-14,16H,1,7-12H2,2-5H3.
What are the key properties of 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine?
2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-piperidin-3-yl-N-propan-2-yl-N-prop-2-enylpropan-1-amine is sourced from PubChem (CID 83199239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).