(1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol

C8H16N2O — CID 69254729

IUPAC(1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol
SMILESCC1N(C)C=CC(CO)N1C
InChIInChI=1S/C8H16N2O/c1-7-9(2)5-4-8(6-11)10(7)3/h4-5,7-8,11H,6H2,1-3H3
InChIKeySKUUSKQGFXPRDN-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.08
Rot. Bonds1

About (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol

(1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol (PubChem CID 69254729) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol.

Molecular Properties

Compound Name(1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol
PubChem CID69254729
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name(1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol
SMILESCC1N(C)C=CC(CO)N1C
InChIInChI=1S/C8H16N2O/c1-7-9(2)5-4-8(6-11)10(7)3/h4-5,7-8,11H,6H2,1-3H3
InChIKeySKUUSKQGFXPRDN-UHFFFAOYSA-N
XLogP0.08
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,3-bis(2-hydroxyethyl)-4-methyl-4H-pyrimidin-2-one
CID 21953638
1,3-bis(2-hydroxyethyl)-4-methyl-4H-pyrimidine-2-thione
CID 21953699
[2-(Dimethylamino)-1,3-dimethyl-2,4-dihydropyrimidin-4-yl]methanol
CID 68454934
(1,3-Dimethyl-2,4-dihydropyrimidin-4-yl)methanol
CID 68455694
(4S)-3-ethyl-4-(hydroxymethyl)-1-prop-2-enoxy-4H-pyrimidin-2-one
CID 129035063
2-(2,3-Dimethyl-2,4-dihydropyrimidin-1-yl)ethanol
CID 151996678
[1-(diethylaminomethyl)-2H-pyridin-2-yl]methanol
CID 153889538
1-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2,4-dihydropyrimidin-2-ol
CID 156143640
1,3-bis(2-hydroxyethyl)-4-methyl-4H-pyrimidine-2-thione;hydrochloride
CID 173162368
1,3-bis(2-hydroxyethyl)-4-methyl-4H-pyrimidin-2-one;hydrochloride
CID 173182831
2-(1,3-Dimethyl-2,4-dihydropyrimidin-1-ium-1-yl)ethanol
CID 175421827

Frequently Asked Questions

What is the IUPAC name of (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol?
The IUPAC name of (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol (CID 69254729) is (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol.
What is the SMILES notation for (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol?
The canonical SMILES for (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol is CC1N(C)C=CC(CO)N1C.
What is the InChIKey of (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol?
The InChIKey is SKUUSKQGFXPRDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7-9(2)5-4-8(6-11)10(7)3/h4-5,7-8,11H,6H2,1-3H3.
What are the key properties of (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol?
(1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol has a molecular weight of 156.23 g/mol, XLogP of 0.08, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2,3-trimethyl-2,4-dihydropyrimidin-4-yl)methanol is sourced from PubChem (CID 69254729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).