2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol

C14H18N4O — CID 105060904

IUPAC2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
SMILESCc1nc(N)cc(NC(C)(CO)c2ccccc2)n1
InChIInChI=1S/C14H18N4O/c1-10-16-12(15)8-13(17-10)18-14(2,9-19)11-6-4-3-5-7-11/h3-8,19H,9H2,1-2H3,(H3,15,16,17,18)
InChIKeySQYCMSDIDSRVKB-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.69
Rot. Bonds4

About 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol

2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol (PubChem CID 105060904) has the molecular formula C14H18N4O and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol.

Molecular Properties

Compound Name2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
PubChem CID105060904
Molecular FormulaC14H18N4O
Molecular Weight258.32 g/mol
Exact Mass258.15
IUPAC Name2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
SMILESCc1nc(N)cc(NC(C)(CO)c2ccccc2)n1
InChIInChI=1S/C14H18N4O/c1-10-16-12(15)8-13(17-10)18-14(2,9-19)11-6-4-3-5-7-11/h3-8,19H,9H2,1-2H3,(H3,15,16,17,18)
InChIKeySQYCMSDIDSRVKB-UHFFFAOYSA-N
XLogP1.69
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[(6-amino-2,5-dimethylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 105060879
2-[(5-tert-butyl-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 107874941
2-(4-amino-2-methylanilino)-2-phenylpropan-1-ol
CID 105057718
2-[(6-methylsulfanylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 106973096
2-[(6-bromo-2-propylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol
CID 105058671
2-cyclopropyl-4-[(1-hydroxy-2-phenylpropan-2-yl)amino]-1H-pyrimidin-6-one
CID 136803028
2-[(6-ethoxy-2-pyridinyl)amino]-2-phenylpropan-1-ol
CID 105058536
2-[(4-amino-3-methyl-1-propylpyrazol-5-yl)amino]-2-phenylpropan-1-ol
CID 105057764
1-[2-amino-4-[(1-hydroxy-2-phenylpropan-2-yl)amino]phenyl]ethanone
CID 105057753
2-(2-amino-5-bromoanilino)-2-phenylpropan-1-ol
CID 105057762
2-[(4-ethyl-1,3-thiazol-2-yl)amino]-2-phenylpropan-1-ol
CID 105058433
2-methyl-4-N-(4-phenylbutyl)pyrimidine-4,6-diamine
CID 11043367

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol?
The IUPAC name of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol (CID 105060904) is 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol.
What is the SMILES notation for 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol?
The canonical SMILES for 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol is Cc1nc(N)cc(NC(C)(CO)c2ccccc2)n1.
What is the InChIKey of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol?
The InChIKey is SQYCMSDIDSRVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c1-10-16-12(15)8-13(17-10)18-14(2,9-19)11-6-4-3-5-7-11/h3-8,19H,9H2,1-2H3,(H3,15,16,17,18).
What are the key properties of 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol?
2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol has a molecular weight of 258.32 g/mol, XLogP of 1.69, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-amino-2-methylpyrimidin-4-yl)amino]-2-phenylpropan-1-ol is sourced from PubChem (CID 105060904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).