3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol

C9H20N2O — CID 84731989

IUPAC3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol
SMILESCN(C)CC1(O)CCCN(C)C1
InChIInChI=1S/C9H20N2O/c1-10(2)7-9(12)5-4-6-11(3)8-9/h12H,4-8H2,1-3H3
InChIKeyRIEYUODJIPZSIL-UHFFFAOYSA-N
MW172.27 g/mol
LogP0.00
Rot. Bonds2

About 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol

3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol (PubChem CID 84731989) has the molecular formula C9H20N2O and a molecular weight of 172.27 g/mol. Its IUPAC name is 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol.

Molecular Properties

Compound Name3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol
PubChem CID84731989
Molecular FormulaC9H20N2O
Molecular Weight172.27 g/mol
Exact Mass172.16
IUPAC Name3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol
SMILESCN(C)CC1(O)CCCN(C)C1
InChIInChI=1S/C9H20N2O/c1-10(2)7-9(12)5-4-6-11(3)8-9/h12H,4-8H2,1-3H3
InChIKeyRIEYUODJIPZSIL-UHFFFAOYSA-N
XLogP0.00
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.27
LogP ≤ 50.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-3-ethyl-1-methylpiperidin-3-ol
CID 177186761
(3S)-3-(aminomethyl)-1-methylpiperidin-3-ol
CID 94998579
1-[(dimethylamino)methyl]cycloheptan-1-ol
CID 104550048
1-(3-ethyl-1-methylpiperidin-3-yl)-N,N-dimethylmethanamine
CID 143448779
2-(3-hydroxy-1-methylpiperidin-3-yl)acetic acid
CID 80503158
[3-[(dimethylamino)methyl]-3-hydroxypyrrolidin-1-yl]-(1-methylpiperidin-3-yl)methanone
CID 110108798
3-[[furan-2-ylmethyl(methyl)amino]methyl]-1-methylpiperidin-3-ol
CID 56728327
(3S)-3-[(dimethylamino)methyl]-1-(3,6-dimethylpyrazin-2-yl)piperidin-3-ol
CID 95866834
1-[(3,5-dichloro-4-pyridinyl)methyl]-3-[(dimethylamino)methyl]piperidin-3-ol
CID 56916014
[3-[(dimethylamino)methyl]-3-hydroxypiperidin-1-yl]-(5-methyl-1H-imidazol-4-yl)methanone
CID 56914584
(3S)-3-ethyl-1-methylpyrrolidin-3-ol
CID 166166966
2-[[3-[(dimethylamino)methyl]-3-hydroxypiperidin-1-yl]methyl]benzoic acid
CID 77081860

Frequently Asked Questions

What is the IUPAC name of 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol?
The IUPAC name of 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol (CID 84731989) is 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol.
What is the SMILES notation for 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol?
The canonical SMILES for 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol is CN(C)CC1(O)CCCN(C)C1.
What is the InChIKey of 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol?
The InChIKey is RIEYUODJIPZSIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O/c1-10(2)7-9(12)5-4-6-11(3)8-9/h12H,4-8H2,1-3H3.
What are the key properties of 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol?
3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol has a molecular weight of 172.27 g/mol, XLogP of 0.00, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(dimethylamino)methyl]-1-methylpiperidin-3-ol is sourced from PubChem (CID 84731989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).