1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine

C12H24N2O — CID 81345344

IUPAC1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine
SMILESCC1CC(NCC2(C)COC2)CCN1C
InChIInChI=1S/C12H24N2O/c1-10-6-11(4-5-14(10)3)13-7-12(2)8-15-9-12/h10-11,13H,4-9H2,1-3H3
InChIKeyIHBDRLDVNRTTAW-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.10
Rot. Bonds3

About 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine

1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine (PubChem CID 81345344) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine.

Molecular Properties

Compound Name1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine
PubChem CID81345344
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine
SMILESCC1CC(NCC2(C)COC2)CCN1C
InChIInChI=1S/C12H24N2O/c1-10-6-11(4-5-14(10)3)13-7-12(2)8-15-9-12/h10-11,13H,4-9H2,1-3H3
InChIKeyIHBDRLDVNRTTAW-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine?
The IUPAC name of 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine (CID 81345344) is 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine.
What is the SMILES notation for 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine?
The canonical SMILES for 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine is CC1CC(NCC2(C)COC2)CCN1C.
What is the InChIKey of 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine?
The InChIKey is IHBDRLDVNRTTAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-10-6-11(4-5-14(10)3)13-7-12(2)8-15-9-12/h10-11,13H,4-9H2,1-3H3.
What are the key properties of 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine?
1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine has a molecular weight of 212.34 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethyl-N-[(3-methyloxetan-3-yl)methyl]piperidin-4-amine is sourced from PubChem (CID 81345344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).