2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol

C15H19N3O — CID 55157881

IUPAC2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol
SMILESCCCc1cc(NC(CO)c2ccccc2)ncn1
InChIInChI=1S/C15H19N3O/c1-2-6-13-9-15(17-11-16-13)18-14(10-19)12-7-4-3-5-8-12/h3-5,7-9,11,14,19H,2,6,10H2,1H3,(H,16,17,18)
InChIKeyRSRHWZMZDHURLL-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.57
Rot. Bonds6

About 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol

2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol (PubChem CID 55157881) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol
PubChem CID55157881
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol
SMILESCCCc1cc(NC(CO)c2ccccc2)ncn1
InChIInChI=1S/C15H19N3O/c1-2-6-13-9-15(17-11-16-13)18-14(10-19)12-7-4-3-5-8-12/h3-5,7-9,11,14,19H,2,6,10H2,1H3,(H,16,17,18)
InChIKeyRSRHWZMZDHURLL-UHFFFAOYSA-N
XLogP2.57
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-[(6-chloropyrimidin-4-yl)amino]-2-phenylethanol
CID 129369078
(2S)-2-[(6-ethyl-2-methylpyrimidin-4-yl)amino]-2-phenylethanol
CID 133460882
N-[1-(3-aminophenyl)ethyl]-6-propylpyrimidin-4-amine
CID 61240540
2-[(6-propylpyrimidin-4-yl)amino]hexanoic acid
CID 61241478
N-octan-4-yl-6-propylpyrimidin-4-amine
CID 106026552
N-(2-phenylethyl)-6-propylpyrimidin-4-amine
CID 61240140
2-[[6-(ethylamino)-2-pyridinyl]amino]-2-phenylethanol
CID 80827704
N-(2-phenylsulfanylethyl)-6-propylpyrimidin-4-amine
CID 61239569
N-[1-(5-methylthiophen-2-yl)ethyl]-6-propylpyrimidin-4-amine
CID 54953837
N-(5-methylhexan-2-yl)-6-propylpyrimidin-4-amine
CID 63926924
2-[(2-hydroxy-1-phenylethyl)amino]pyridine-4-carbonitrile
CID 63183198
methyl 2-[(6-ethylpyrimidin-4-yl)amino]-2-phenylacetate
CID 62109290

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol (CID 55157881) is 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol is CCCc1cc(NC(CO)c2ccccc2)ncn1.
What is the InChIKey of 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol?
The InChIKey is RSRHWZMZDHURLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-2-6-13-9-15(17-11-16-13)18-14(10-19)12-7-4-3-5-8-12/h3-5,7-9,11,14,19H,2,6,10H2,1H3,(H,16,17,18).
What are the key properties of 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol?
2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol has a molecular weight of 257.34 g/mol, XLogP of 2.57, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-[(6-propylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 55157881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).