(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol

C11H16N2O — CID 126974115

IUPAC(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol
SMILESCC(C)c1nc(C2CC2)ncc1CO
InChIInChI=1S/C11H16N2O/c1-7(2)10-9(6-14)5-12-11(13-10)8-3-4-8/h5,7-8,14H,3-4,6H2,1-2H3
InChIKeyYYFXHQVLGJYUBK-UHFFFAOYSA-N
MW192.26 g/mol
LogP1.97
Rot. Bonds3

About (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol

(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol (PubChem CID 126974115) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol.

Molecular Properties

Compound Name(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol
PubChem CID126974115
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol
SMILESCC(C)c1nc(C2CC2)ncc1CO
InChIInChI=1S/C11H16N2O/c1-7(2)10-9(6-14)5-12-11(13-10)8-3-4-8/h5,7-8,14H,3-4,6H2,1-2H3
InChIKeyYYFXHQVLGJYUBK-UHFFFAOYSA-N
XLogP1.97
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N'-(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)ethane-1,2-diamine
CID 117212057
[2-(1-methoxy-2-methylpropyl)-4-propan-2-ylpyrimidin-5-yl]methanol
CID 114205111
(4-propan-2-ylpyrimidin-5-yl)methanol
CID 130163917
N-[(2-cyclobutyl-4-methylpyrimidin-5-yl)methyl]-2-methylpropan-1-amine
CID 114206549
1-(2-cyclopropyl-4-methoxypyrimidin-5-yl)propan-2-one
CID 83882775
[2-(3-methylcyclohexyl)-4-propylpyrimidin-5-yl]methanol
CID 114205023
2-(2-cyclopropyl-4-methylsulfanylpyrimidin-5-yl)ethanamine
CID 83852227
2-(2-cyclopentyl-5-methoxypyrimidin-4-yl)propan-1-amine
CID 83896746
(5-cyclopropyl-1-propan-2-ylpyrazol-4-yl)methanol
CID 66436592
(4-chloro-2-cyclobutylpyrimidin-5-yl)methanamine
CID 83852073
5-(bromomethyl)-4-(difluoromethyl)-2-(3-ethylcyclohexyl)pyrimidine
CID 114205872
2-cyclopropyl-4-ethyl-5-methylpyrimidine
CID 123992925

Frequently Asked Questions

What is the IUPAC name of (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol?
The IUPAC name of (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol (CID 126974115) is (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol.
What is the SMILES notation for (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol?
The canonical SMILES for (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol is CC(C)c1nc(C2CC2)ncc1CO.
What is the InChIKey of (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol?
The InChIKey is YYFXHQVLGJYUBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-7(2)10-9(6-14)5-12-11(13-10)8-3-4-8/h5,7-8,14H,3-4,6H2,1-2H3.
What are the key properties of (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol?
(2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol has a molecular weight of 192.26 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropyl-4-propan-2-ylpyrimidin-5-yl)methanol is sourced from PubChem (CID 126974115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).