(1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol

C6H12N4O — CID 89306284

IUPAC(1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol
SMILESCc1nn([C@@H](C)O)c(N)c1N
InChIInChI=1S/C6H12N4O/c1-3-5(7)6(8)10(9-3)4(2)11/h4,11H,7-8H2,1-2H3/t4-/m1/s1
InChIKeyVIYHFOAUCXWWBH-SCSAIBSYSA-N
MW156.19 g/mol
LogP-0.13
Rot. Bonds1

About (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol

(1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol (PubChem CID 89306284) has the molecular formula C6H12N4O and a molecular weight of 156.19 g/mol. Its IUPAC name is (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol.

Molecular Properties

Compound Name(1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol
PubChem CID89306284
Molecular FormulaC6H12N4O
Molecular Weight156.19 g/mol
Exact Mass156.10
IUPAC Name(1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol
SMILESCc1nn([C@@H](C)O)c(N)c1N
InChIInChI=1S/C6H12N4O/c1-3-5(7)6(8)10(9-3)4(2)11/h4,11H,7-8H2,1-2H3/t4-/m1/s1
InChIKeyVIYHFOAUCXWWBH-SCSAIBSYSA-N
XLogP-0.13
TPSA90.09 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol with MolForge

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Related Compounds

2-(5-Amino-3-methyl-1H-pyrazol-1-yl)ethan-1-ol
CID 5018373
5-Amino-1-(2-hydroxyethyl)-3-methyl-1H-pyrazole-4-carbonitrile
CID 219873
2-(5-amino-3-methyl-4-nitro-1H-pyrazol-1-yl)ethan-1-ol
CID 61735054
1,5-Dimethyl-1H-pyrazole-3,4-diamine
CID 544940
2-(5-amino-4-bromo-3-methyl-1H-pyrazol-1-yl)ethan-1-ol
CID 61733536
N5-ethyl-1,3-dimethyl-1H-pyrazole-4,5-diamine hydrochloride
CID 154857210
N5-Ethyl-1,3-dimethyl-1H-pyrazole-4,5-diamine
CID 43554024
3-[(4-Amino-1,3-dimethylpyrazol-5-yl)amino]-1,1,1-trifluoropropan-2-ol
CID 105642104
3-[(4-Amino-3-methyl-1-propan-2-ylpyrazol-5-yl)amino]-1,1,1-trifluoropropan-2-ol
CID 105642321
3-[(4-Amino-1,3-dimethylpyrazol-5-yl)amino]-1,1-difluoropropan-2-ol
CID 105642455
3-[(4-Amino-3-methyl-1-propylpyrazol-5-yl)amino]-1,1-difluoropropan-2-ol
CID 105642584
3-[(4-Amino-1-ethyl-3-methylpyrazol-5-yl)amino]-1,1-difluoropropan-2-ol
CID 105642616

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol?
The IUPAC name of (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol (CID 89306284) is (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol.
What is the SMILES notation for (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol?
The canonical SMILES for (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol is Cc1nn([C@@H](C)O)c(N)c1N.
What is the InChIKey of (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol?
The InChIKey is VIYHFOAUCXWWBH-SCSAIBSYSA-N. The full InChI is InChI=1S/C6H12N4O/c1-3-5(7)6(8)10(9-3)4(2)11/h4,11H,7-8H2,1-2H3/t4-/m1/s1.
What are the key properties of (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol?
(1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol has a molecular weight of 156.19 g/mol, XLogP of -0.13, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(4,5-diamino-3-methylpyrazol-1-yl)ethanol is sourced from PubChem (CID 89306284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).