N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide

C11H18N6O — CID 80922661

IUPACN-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide
SMILESCc1c(NN)ncnc1NCCC(=O)NC1CC1
InChIInChI=1S/C11H18N6O/c1-7-10(14-6-15-11(7)17-12)13-5-4-9(18)16-8-2-3-8/h6,8H,2-5,12H2,1H3,(H,16,18)(H2,13,14,15,17)
InChIKeyWOJHMTOSHBWHTC-UHFFFAOYSA-N
MW250.31 g/mol
LogP0.15
Rot. Bonds6

About N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide

N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide (PubChem CID 80922661) has the molecular formula C11H18N6O and a molecular weight of 250.31 g/mol. Its IUPAC name is N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide
PubChem CID80922661
Molecular FormulaC11H18N6O
Molecular Weight250.31 g/mol
Exact Mass250.15
IUPAC NameN-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide
SMILESCc1c(NN)ncnc1NCCC(=O)NC1CC1
InChIInChI=1S/C11H18N6O/c1-7-10(14-6-15-11(7)17-12)13-5-4-9(18)16-8-2-3-8/h6,8H,2-5,12H2,1H3,(H,16,18)(H2,13,14,15,17)
InChIKeyWOJHMTOSHBWHTC-UHFFFAOYSA-N
XLogP0.15
TPSA104.96 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.31
LogP ≤ 50.15
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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

N-cyclopropyl-2-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]acetamide
CID 80907485
N-cyclopropyl-4-[(6-ethoxy-5-methylpyrimidin-4-yl)amino]butanamide
CID 79400749
3-[(2-amino-5-methylpyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 80849479
N-cyclopropyl-3-[(3-methylsulfonyl-2-pyridinyl)amino]propanamide
CID 114598969
ethyl 4-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]butanoate
CID 80915942
3-[(6-chloro-5-nitropyrimidin-4-yl)amino]-N-cyclopropylpropanamide
CID 79401733
3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propan-1-ol
CID 80943609
N-cyclopentyl-3-[(3,6-dimethylpyrazin-2-yl)amino]propanamide
CID 91648208
3-[[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]methyl]cyclobutan-1-ol
CID 80922260
6-hydrazinyl-5-methyl-N-[2-(4-methylcyclohexyl)ethyl]pyrimidin-4-amine
CID 80913396
ethyl 3-[[5-methyl-6-(propylamino)pyrimidin-4-yl]amino]propanoate
CID 80816605
N-cyclopropyl-3-[(4,6-dimethylpyrimidin-2-yl)amino]propanamide
CID 79393988

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide?
The IUPAC name of N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide (CID 80922661) is N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide.
What is the SMILES notation for N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide?
The canonical SMILES for N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide is Cc1c(NN)ncnc1NCCC(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide?
The InChIKey is WOJHMTOSHBWHTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6O/c1-7-10(14-6-15-11(7)17-12)13-5-4-9(18)16-8-2-3-8/h6,8H,2-5,12H2,1H3,(H,16,18)(H2,13,14,15,17).
What are the key properties of N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide?
N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide has a molecular weight of 250.31 g/mol, XLogP of 0.15, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3-[(6-hydrazinyl-5-methylpyrimidin-4-yl)amino]propanamide is sourced from PubChem (CID 80922661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).