2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine

C12H24N2 — CID 130871447

IUPAC2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine
SMILESCC1CNCC(CNC2CC2(C)C)C1
InChIInChI=1S/C12H24N2/c1-9-4-10(7-13-6-9)8-14-11-5-12(11,2)3/h9-11,13-14H,4-8H2,1-3H3
InChIKeyXDDNDCHWBJMZLE-UHFFFAOYSA-N
MW196.34 g/mol
LogP1.62
Rot. Bonds3

About 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine

2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine (PubChem CID 130871447) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine
PubChem CID130871447
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine
SMILESCC1CNCC(CNC2CC2(C)C)C1
InChIInChI=1S/C12H24N2/c1-9-4-10(7-13-6-9)8-14-11-5-12(11,2)3/h9-11,13-14H,4-8H2,1-3H3
InChIKeyXDDNDCHWBJMZLE-UHFFFAOYSA-N
XLogP1.62
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine?
The IUPAC name of 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine (CID 130871447) is 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine is CC1CNCC(CNC2CC2(C)C)C1.
What is the InChIKey of 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine?
The InChIKey is XDDNDCHWBJMZLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-9-4-10(7-13-6-9)8-14-11-5-12(11,2)3/h9-11,13-14H,4-8H2,1-3H3.
What are the key properties of 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine?
2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine has a molecular weight of 196.34 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[(5-methylpiperidin-3-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 130871447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).