2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol

C9H16N4O — CID 80981938

IUPAC2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol
SMILESCCc1nc(N)c(C)c(NCCO)n1
InChIInChI=1S/C9H16N4O/c1-3-7-12-8(10)6(2)9(13-7)11-4-5-14/h14H,3-5H2,1-2H3,(H3,10,11,12,13)
InChIKeyPQSWKUOCJCHQDQ-UHFFFAOYSA-N
MW196.25 g/mol
LogP0.33
Rot. Bonds4

About 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol

2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol (PubChem CID 80981938) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol
PubChem CID80981938
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol
SMILESCCc1nc(N)c(C)c(NCCO)n1
InChIInChI=1S/C9H16N4O/c1-3-7-12-8(10)6(2)9(13-7)11-4-5-14/h14H,3-5H2,1-2H3,(H3,10,11,12,13)
InChIKeyPQSWKUOCJCHQDQ-UHFFFAOYSA-N
XLogP0.33
TPSA84.06 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.33
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-butyl-2-ethyl-5-methylpyrimidine-4,6-diamine
CID 80980996
4-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]-3,3-dimethylbutan-1-ol
CID 106149768
2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]ethanol
CID 80981481
2-[2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethoxy]acetamide
CID 106241829
2-ethyl-5-methyl-4-N-(2,2,2-trifluoroethyl)pyrimidine-4,6-diamine
CID 80981531
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]-N-ethylacetamide
CID 80994073
2-ethyl-5-methyl-4-N-[2-(2,2,2-trifluoroethoxy)ethyl]pyrimidine-4,6-diamine
CID 80984168
4-N-[2-(3,5-difluorophenyl)ethyl]-2-ethyl-5-methylpyrimidine-4,6-diamine
CID 80985293
2-ethyl-5-methyl-4-N-(3-phenylpropyl)pyrimidine-4,6-diamine
CID 80986988
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]-2-ethylbutan-1-ol
CID 80983064
2-ethyl-5-methyl-4-N-(2-thiomorpholin-4-ylethyl)pyrimidine-4,6-diamine
CID 106327553
3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]-3-methylbutanamide
CID 106098699

Frequently Asked Questions

What is the IUPAC name of 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol (CID 80981938) is 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol is CCc1nc(N)c(C)c(NCCO)n1.
What is the InChIKey of 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol?
The InChIKey is PQSWKUOCJCHQDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-3-7-12-8(10)6(2)9(13-7)11-4-5-14/h14H,3-5H2,1-2H3,(H3,10,11,12,13).
What are the key properties of 2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol?
2-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]ethanol has a molecular weight of 196.25 g/mol, XLogP of 0.33, 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-ethyl-5-methylpyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 80981938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).