2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol

C12H18N6O — CID 121499577

IUPAC2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol
SMILESCCCn1nccc1-c1cc(NCCO)nc(N)n1
InChIInChI=1S/C12H18N6O/c1-2-6-18-10(3-4-15-18)9-8-11(14-5-7-19)17-12(13)16-9/h3-4,8,19H,2,5-7H2,1H3,(H3,13,14,16,17)
InChIKeyRLFCAZXQXCXOAO-UHFFFAOYSA-N
MW262.32 g/mol
LogP0.74
Rot. Bonds6

About 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol

2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol (PubChem CID 121499577) has the molecular formula C12H18N6O and a molecular weight of 262.32 g/mol. Its IUPAC name is 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol
PubChem CID121499577
Molecular FormulaC12H18N6O
Molecular Weight262.32 g/mol
Exact Mass262.15
IUPAC Name2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol
SMILESCCCn1nccc1-c1cc(NCCO)nc(N)n1
InChIInChI=1S/C12H18N6O/c1-2-6-18-10(3-4-15-18)9-8-11(14-5-7-19)17-12(13)16-9/h3-4,8,19H,2,5-7H2,1H3,(H3,13,14,16,17)
InChIKeyRLFCAZXQXCXOAO-UHFFFAOYSA-N
XLogP0.74
TPSA101.88 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 50.74
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-propyl-2-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 114557298
6-(2-propylpyrazol-3-yl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106769510
6-(methoxymethyl)-N-propyl-2-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 114557330
6-(2-ethylpyrazol-3-yl)-N-propyl-4-(trifluoromethyl)pyridin-2-amine
CID 102716720
2-[[2-amino-6-[4-(2-aminoethyl)phenyl]pyrimidin-4-yl]amino]ethanol
CID 162636438
3-[2-amino-6-(2-hydroxyethylamino)pyrimidin-4-yl]cyclobutan-1-ol
CID 91761176
5,6-dimethyl-N-propyl-2-(2-propylpyrazol-3-yl)pyrimidin-4-amine
CID 114557302
6-(2-methylpyrazol-3-yl)-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 80952418
4-methyl-2-[(3R)-piperidin-3-yl]-6-(2-propylpyrazol-3-yl)pyrimidine
CID 124971396
6-methyl-4-N-(2-pyrazol-1-ylethyl)pyrimidine-2,4-diamine
CID 112732592
6-N-methyl-4-N-propylpyrimidine-2,4,6-triamine
CID 80766256
6-chloro-4-N-[2-(2-methylpyrazol-3-yl)ethyl]pyrimidine-2,4-diamine
CID 104695947

Frequently Asked Questions

What is the IUPAC name of 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol?
The IUPAC name of 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol (CID 121499577) is 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol.
What is the SMILES notation for 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol?
The canonical SMILES for 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol is CCCn1nccc1-c1cc(NCCO)nc(N)n1.
What is the InChIKey of 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol?
The InChIKey is RLFCAZXQXCXOAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N6O/c1-2-6-18-10(3-4-15-18)9-8-11(14-5-7-19)17-12(13)16-9/h3-4,8,19H,2,5-7H2,1H3,(H3,13,14,16,17).
What are the key properties of 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol?
2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol has a molecular weight of 262.32 g/mol, XLogP of 0.74, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-amino-6-(2-propylpyrazol-3-yl)pyrimidin-4-yl]amino]ethanol is sourced from PubChem (CID 121499577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).