3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine

C11H24N2O — CID 91099073

IUPAC3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine
SMILESCC(CN)COC1(C)CCN(C)CC1
InChIInChI=1S/C11H24N2O/c1-10(8-12)9-14-11(2)4-6-13(3)7-5-11/h10H,4-9,12H2,1-3H3
InChIKeyOVHGZRRZTXVIKJ-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.08
Rot. Bonds4

About 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine

3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine (PubChem CID 91099073) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine
PubChem CID91099073
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine
SMILESCC(CN)COC1(C)CCN(C)CC1
InChIInChI=1S/C11H24N2O/c1-10(8-12)9-14-11(2)4-6-13(3)7-5-11/h10H,4-9,12H2,1-3H3
InChIKeyOVHGZRRZTXVIKJ-UHFFFAOYSA-N
XLogP1.08
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2-Methoxyethyl)piperidin-4-yl]methanamine
CID 28063523
4-(2-Methylpropoxy)piperidine
CID 11701188
Dimethyl[3-(piperidin-4-yloxy)propyl]amine
CID 61103075
1-(3-Ethoxypropyl)-3-methylpiperidin-4-amine
CID 54593711
4-[(Tert-butoxy)methyl]piperidine hydrochloride
CID 137944107
4-[(Tert-butoxy)methyl]piperidine
CID 54056421
N-fluoro-3-[[1-(2-methylpropyl)piperidin-4-yl]methoxy]propan-1-amine
CID 155739455
(2R)-2-fluoro-3-[(1-methylpiperidin-4-yl)methoxy]propan-1-amine
CID 166536767
N-fluoro-3-[1-(2-methylpropyl)piperidin-4-yl]oxypropan-1-amine
CID 167156405
2-[1-[3-(2,2,2-Trifluoroethoxy)propyl]piperidin-4-yl]ethanamine
CID 54989205
[1-[3-(2,2,2-Trifluoroethoxy)propyl]piperidin-4-yl]methanamine
CID 61490977
N-[(1-methylpiperidin-4-yl)methyl]-3-(2,2,2-trifluoroethoxy)propan-1-amine
CID 61788746

Frequently Asked Questions

What is the IUPAC name of 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine?
The IUPAC name of 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine (CID 91099073) is 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine.
What is the SMILES notation for 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine?
The canonical SMILES for 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine is CC(CN)COC1(C)CCN(C)CC1.
What is the InChIKey of 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine?
The InChIKey is OVHGZRRZTXVIKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-10(8-12)9-14-11(2)4-6-13(3)7-5-11/h10H,4-9,12H2,1-3H3.
What are the key properties of 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine?
3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine has a molecular weight of 200.33 g/mol, XLogP of 1.08, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,4-dimethylpiperidin-4-yl)oxy-2-methylpropan-1-amine is sourced from PubChem (CID 91099073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).