N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide

C12H16N6O2 — CID 19135482

IUPACN'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide
SMILESCCCNc1ncnc(NNC(=O)c2ccco2)c1N
InChIInChI=1S/C12H16N6O2/c1-2-5-14-10-9(13)11(16-7-15-10)17-18-12(19)8-4-3-6-20-8/h3-4,6-7H,2,5,13H2,1H3,(H,18,19)(H2,14,15,16,17)
InChIKeyFENRYYYNVUOADX-UHFFFAOYSA-N
MW276.30 g/mol
LogP1.23
Rot. Bonds6

About N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide

N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide (PubChem CID 19135482) has the molecular formula C12H16N6O2 and a molecular weight of 276.30 g/mol. Its IUPAC name is N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide.

Molecular Properties

Compound NameN'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide
PubChem CID19135482
Molecular FormulaC12H16N6O2
Molecular Weight276.30 g/mol
Exact Mass276.13
IUPAC NameN'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide
SMILESCCCNc1ncnc(NNC(=O)c2ccco2)c1N
InChIInChI=1S/C12H16N6O2/c1-2-5-14-10-9(13)11(16-7-15-10)17-18-12(19)8-4-3-6-20-8/h3-4,6-7H,2,5,13H2,1H3,(H,18,19)(H2,14,15,16,17)
InChIKeyFENRYYYNVUOADX-UHFFFAOYSA-N
XLogP1.23
TPSA118.10 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 51.23
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-[5-amino-6-(3-methoxypropylamino)pyrimidin-4-yl]furan-2-carbohydrazide
CID 19144226
N'-[5-amino-6-(2-piperidin-1-ylethylamino)pyrimidin-4-yl]furan-2-carbohydrazide
CID 19143794
N'-[5-amino-6-[2-(2-phenylacetyl)hydrazinyl]pyrimidin-4-yl]furan-2-carbohydrazide
CID 19152033
N'-[5-amino-6-[bis(2-methylpropyl)amino]pyrimidin-4-yl]furan-2-carbohydrazide
CID 19141013
ethyl 2-[[5-amino-6-[2-(furan-2-carbonyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate
CID 19152080
N'-[5-amino-6-(benzhydrylamino)pyrimidin-4-yl]furan-2-carbohydrazide
CID 19150190
N'-[5-amino-6-(2,3-dimethylanilino)pyrimidin-4-yl]furan-2-carbohydrazide
CID 19143204
ethyl 3-[[5-amino-6-[2-(furan-2-carbonyl)hydrazinyl]pyrimidin-4-yl]amino]benzoate
CID 19152054
N'-[5-amino-6-(propylamino)pyrimidin-4-yl]-2,4-dichlorobenzohydrazide
CID 19135477
N'-[5-amino-6-[(5-chloro-2-pyridinyl)amino]pyrimidin-4-yl]furan-2-carbohydrazide
CID 19147119
N'-[5-amino-6-(2,5-dichloroanilino)pyrimidin-4-yl]furan-2-carbohydrazide
CID 19146753
N'-[6-(3-methoxypropylamino)-5-nitropyrimidin-4-yl]furan-2-carbohydrazide
CID 22526553

Frequently Asked Questions

What is the IUPAC name of N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide?
The IUPAC name of N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide (CID 19135482) is N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide.
What is the SMILES notation for N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide?
The canonical SMILES for N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide is CCCNc1ncnc(NNC(=O)c2ccco2)c1N.
What is the InChIKey of N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide?
The InChIKey is FENRYYYNVUOADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O2/c1-2-5-14-10-9(13)11(16-7-15-10)17-18-12(19)8-4-3-6-20-8/h3-4,6-7H,2,5,13H2,1H3,(H,18,19)(H2,14,15,16,17).
What are the key properties of N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide?
N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide has a molecular weight of 276.30 g/mol, XLogP of 1.23, 6 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[5-amino-6-(propylamino)pyrimidin-4-yl]furan-2-carbohydrazide is sourced from PubChem (CID 19135482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).