[2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol

C13H20N2O2 — CID 114205020

IUPAC[2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol
SMILESCCCc1nc(C(OC)C2CC2)ncc1CO
InChIInChI=1S/C13H20N2O2/c1-3-4-11-10(8-16)7-14-13(15-11)12(17-2)9-5-6-9/h7,9,12,16H,3-6,8H2,1-2H3
InChIKeySZQAOBOVUJPWFR-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.02
Rot. Bonds6

About [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol

[2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol (PubChem CID 114205020) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol.

Molecular Properties

Compound Name[2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol
PubChem CID114205020
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol
SMILESCCCc1nc(C(OC)C2CC2)ncc1CO
InChIInChI=1S/C13H20N2O2/c1-3-4-11-10(8-16)7-14-13(15-11)12(17-2)9-5-6-9/h7,9,12,16H,3-6,8H2,1-2H3
InChIKeySZQAOBOVUJPWFR-UHFFFAOYSA-N
XLogP2.02
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-[cyclopropyl(ethoxy)methyl]-4-(difluoromethyl)pyrimidin-5-yl]methanol
CID 114205177
[2-[cyclohexyl(methoxy)methyl]pyrimidin-5-yl]methanol
CID 116779001
[4-ethyl-2-(1-methoxy-2,2-dimethylpropyl)pyrimidin-5-yl]methanol
CID 114205053
2-[cyclopropyl(methoxy)methyl]pyrimidin-5-amine
CID 116705149
2-[cyclopropyl(methoxy)methyl]-N-ethyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-5-amine
CID 107385373
[2-(3-methylcyclohexyl)-4-propylpyrimidin-5-yl]methanol
CID 114205023
1-[2-[cyclopropyl(methoxy)methyl]-4-methylpyrimidin-5-yl]-N-methylethanamine
CID 116731318
2-[cyclohexyl(methoxy)methyl]-5-iodopyrimidin-4-amine
CID 116777085
ethyl 2-[cyclopropyl(ethoxy)methyl]-4-ethylpyrimidine-5-carboxylate
CID 102972887
4-chloro-2-[cyclohexyl(methoxy)methyl]-5-iodopyrimidine
CID 116746300
1-[2-[cyclopropyl(methoxy)methyl]pyrimidin-4-yl]-N-methylmethanamine
CID 116731055
2-[cyclopropyl(methoxy)methyl]-N,7,7-trimethyl-6,8-dihydro-5H-quinazolin-5-amine
CID 116728350

Frequently Asked Questions

What is the IUPAC name of [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol?
The IUPAC name of [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol (CID 114205020) is [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol.
What is the SMILES notation for [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol?
The canonical SMILES for [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol is CCCc1nc(C(OC)C2CC2)ncc1CO.
What is the InChIKey of [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol?
The InChIKey is SZQAOBOVUJPWFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-3-4-11-10(8-16)7-14-13(15-11)12(17-2)9-5-6-9/h7,9,12,16H,3-6,8H2,1-2H3.
What are the key properties of [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol?
[2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol has a molecular weight of 236.31 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[cyclopropyl(methoxy)methyl]-4-propylpyrimidin-5-yl]methanol is sourced from PubChem (CID 114205020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).