1,6-dimethylpiperidin-3-ol;ethane

C9H21NO — CID 170766589

IUPAC1,6-dimethylpiperidin-3-ol;ethane
SMILESCC.CC1CCC(O)CN1C
InChIInChI=1S/C7H15NO.C2H6/c1-6-3-4-7(9)5-8(6)2;1-2/h6-7,9H,3-5H2,1-2H3;1-2H3
InChIKeyMHJGKTGLRJWNHG-UHFFFAOYSA-N
MW159.27 g/mol
LogP1.49
Rot. Bonds

About 1,6-dimethylpiperidin-3-ol;ethane

1,6-dimethylpiperidin-3-ol;ethane (PubChem CID 170766589) has the molecular formula C9H21NO and a molecular weight of 159.27 g/mol. Its IUPAC name is 1,6-dimethylpiperidin-3-ol;ethane.

Molecular Properties

Compound Name1,6-dimethylpiperidin-3-ol;ethane
PubChem CID170766589
Molecular FormulaC9H21NO
Molecular Weight159.27 g/mol
Exact Mass159.16
IUPAC Name1,6-dimethylpiperidin-3-ol;ethane
SMILESCC.CC1CCC(O)CN1C
InChIInChI=1S/C7H15NO.C2H6/c1-6-3-4-7(9)5-8(6)2;1-2/h6-7,9H,3-5H2,1-2H3;1-2H3
InChIKeyMHJGKTGLRJWNHG-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.27
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4R,7R)-1,7-dimethylazepan-4-ol
CID 167089908
(3S,5S)-1,5-dimethylpyrrolidin-3-ol
CID 59896080
ethane;1,2,4,5-tetramethylpiperazine
CID 164865311
(3S,6S)-1-tert-butyl-6-methylpiperidin-3-ol
CID 171159721
(3R,6R)-1,6-dimethylpiperidine-3-carboxylic acid
CID 124547889
(6R)-1,6-dimethylpiperidine-3-carboxylic acid
CID 145074333
1-[(2R,5R)-5-hydroxy-2-methylpiperidin-1-yl]ethanone
CID 93498601
1,6-dimethylazepan-3-ol
CID 118230247
2,3,5-trimethyl-1,3,4,5,5a,6,7,8,9,9a-decahydrobenzo[c]azepin-8-ol
CID 123323436
(2R,4R,5S)-1,2,5-trimethylpiperidin-4-ol
CID 98394541
1-(1-hydroxypropan-2-yl)-6-methylpiperidin-3-ol
CID 130854824
acetaldehyde;1,6-dimethylpiperidine-3-carboxamide
CID 156717131

Frequently Asked Questions

What is the IUPAC name of 1,6-dimethylpiperidin-3-ol;ethane?
The IUPAC name of 1,6-dimethylpiperidin-3-ol;ethane (CID 170766589) is 1,6-dimethylpiperidin-3-ol;ethane.
What is the SMILES notation for 1,6-dimethylpiperidin-3-ol;ethane?
The canonical SMILES for 1,6-dimethylpiperidin-3-ol;ethane is CC.CC1CCC(O)CN1C.
What is the InChIKey of 1,6-dimethylpiperidin-3-ol;ethane?
The InChIKey is MHJGKTGLRJWNHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO.C2H6/c1-6-3-4-7(9)5-8(6)2;1-2/h6-7,9H,3-5H2,1-2H3;1-2H3.
What are the key properties of 1,6-dimethylpiperidin-3-ol;ethane?
1,6-dimethylpiperidin-3-ol;ethane has a molecular weight of 159.27 g/mol, XLogP of 1.49, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,6-dimethylpiperidin-3-ol;ethane is sourced from PubChem (CID 170766589), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).