3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide

C8H14N6O3 — CID 106179516

IUPAC3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide
SMILESCOc1c(NN)ncnc1NCC(O)C(N)=O
InChIInChI=1S/C8H14N6O3/c1-17-5-7(11-2-4(15)6(9)16)12-3-13-8(5)14-10/h3-4,15H,2,10H2,1H3,(H2,9,16)(H2,11,12,13,14)
InChIKeyDIRCSRLNZAWDDC-UHFFFAOYSA-N
MW242.24 g/mol
LogP-1.97
Rot. Bonds6

About 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide

3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide (PubChem CID 106179516) has the molecular formula C8H14N6O3 and a molecular weight of 242.24 g/mol. Its IUPAC name is 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide.

Molecular Properties

Compound Name3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide
PubChem CID106179516
Molecular FormulaC8H14N6O3
Molecular Weight242.24 g/mol
Exact Mass242.11
IUPAC Name3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide
SMILESCOc1c(NN)ncnc1NCC(O)C(N)=O
InChIInChI=1S/C8H14N6O3/c1-17-5-7(11-2-4(15)6(9)16)12-3-13-8(5)14-10/h3-4,15H,2,10H2,1H3,(H2,9,16)(H2,11,12,13,14)
InChIKeyDIRCSRLNZAWDDC-UHFFFAOYSA-N
XLogP-1.97
TPSA148.41 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 5-1.97
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-2-hydroxypropanamide
CID 106179504
5-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-methylpentan-1-ol
CID 106163669
4-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-1-methoxybutan-2-ol
CID 106249050
3-[(6-aminoquinazolin-4-yl)amino]-2-hydroxypropanamide
CID 114152808
6-hydrazinyl-5-methoxy-N-(2-propan-2-yloxyethyl)pyrimidin-4-amine
CID 104767453
3-[(5-chloropyrimidin-4-yl)amino]-2-hydroxypropanamide
CID 106170483
3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-4-methylpentan-1-ol
CID 106358434
3-[[6-(ethylamino)-5-methoxypyrimidin-4-yl]amino]-1,1-difluoropropan-2-ol
CID 114094101
3-[[6-(ethylamino)pyrimidin-4-yl]amino]-2-hydroxypropanamide
CID 106178960
1-[[6-(ethylamino)-5-methoxypyrimidin-4-yl]amino]-4-methylpentan-2-ol
CID 107159733
3-[(5-bromo-2-hydrazinylpyrimidin-4-yl)amino]-2-hydroxypropanamide
CID 106179503
3-[[6-(ethylamino)-5-methoxypyrimidin-4-yl]amino]-2,2-dimethylpropanamide
CID 106280657

Frequently Asked Questions

What is the IUPAC name of 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide?
The IUPAC name of 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide (CID 106179516) is 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide.
What is the SMILES notation for 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide?
The canonical SMILES for 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide is COc1c(NN)ncnc1NCC(O)C(N)=O.
What is the InChIKey of 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide?
The InChIKey is DIRCSRLNZAWDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N6O3/c1-17-5-7(11-2-4(15)6(9)16)12-3-13-8(5)14-10/h3-4,15H,2,10H2,1H3,(H2,9,16)(H2,11,12,13,14).
What are the key properties of 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide?
3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide has a molecular weight of 242.24 g/mol, XLogP of -1.97, 6 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(6-hydrazinyl-5-methoxypyrimidin-4-yl)amino]-2-hydroxypropanamide is sourced from PubChem (CID 106179516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).