(1-methyldiazinan-4-yl)methanol

C6H14N2O — CID 84648104

IUPAC(1-methyldiazinan-4-yl)methanol
SMILESCN1CCC(CO)CN1
InChIInChI=1S/C6H14N2O/c1-8-3-2-6(5-9)4-7-8/h6-7,9H,2-5H2,1H3
InChIKeyRVCMJBJWZUIUEY-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.56
Rot. Bonds1

About (1-methyldiazinan-4-yl)methanol

(1-methyldiazinan-4-yl)methanol (PubChem CID 84648104) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is (1-methyldiazinan-4-yl)methanol.

Molecular Properties

Compound Name(1-methyldiazinan-4-yl)methanol
PubChem CID84648104
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name(1-methyldiazinan-4-yl)methanol
SMILESCN1CCC(CO)CN1
InChIInChI=1S/C6H14N2O/c1-8-3-2-6(5-9)4-7-8/h6-7,9H,2-5H2,1H3
InChIKeyRVCMJBJWZUIUEY-UHFFFAOYSA-N
XLogP-0.56
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[2-(azetidin-3-yl)ethyl]piperidin-4-yl]methanol
CID 107391013
[1-(1-sulfanylethyl)piperidin-4-yl]methanol
CID 138616110
[(6R)-1-methyl-1,4-diazepan-6-yl]methanol
CID 92669951
[1-(1-methylpiperidin-4-yl)piperidin-4-yl]methanol
CID 83835284
[(6S)-1-methyl-1,4-diazepan-6-yl]methanol
CID 92669953
6-[4-(hydroxymethyl)piperidin-1-yl]hexan-1-ol
CID 103737785
[(3R,6S)-6-methylpiperidin-3-yl]methanol
CID 96581848
ethane;(1-methylpiperidin-3-yl)methanol
CID 142013659
[(3S,6S)-6-methylpiperidin-3-yl]methanol;hydrochloride
CID 166105009
1,5-diazabicyclo[3.2.2]nonan-3-ylmethanol
CID 126580611
[1-[2-(azetidin-2-yl)ethyl]piperidin-4-yl]methanol
CID 123835791
[(3S)-1-(3-methylbutyl)pyrrolidin-3-yl]methanol
CID 42258964

Frequently Asked Questions

What is the IUPAC name of (1-methyldiazinan-4-yl)methanol?
The IUPAC name of (1-methyldiazinan-4-yl)methanol (CID 84648104) is (1-methyldiazinan-4-yl)methanol.
What is the SMILES notation for (1-methyldiazinan-4-yl)methanol?
The canonical SMILES for (1-methyldiazinan-4-yl)methanol is CN1CCC(CO)CN1.
What is the InChIKey of (1-methyldiazinan-4-yl)methanol?
The InChIKey is RVCMJBJWZUIUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-8-3-2-6(5-9)4-7-8/h6-7,9H,2-5H2,1H3.
What are the key properties of (1-methyldiazinan-4-yl)methanol?
(1-methyldiazinan-4-yl)methanol has a molecular weight of 130.19 g/mol, XLogP of -0.56, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methyldiazinan-4-yl)methanol is sourced from PubChem (CID 84648104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).