2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide

C15H24N4O2 — CID 63584771

IUPAC2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)Cc1ccc(C(=O)NN)cc1
InChIInChI=1S/C15H24N4O2/c1-4-19(10-14(20)17-11(2)3)9-12-5-7-13(8-6-12)15(21)18-16/h5-8,11H,4,9-10,16H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyXPQLWSRLCDOGFL-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.64
Rot. Bonds7

About 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide

2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide (PubChem CID 63584771) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide
PubChem CID63584771
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC Name2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)Cc1ccc(C(=O)NN)cc1
InChIInChI=1S/C15H24N4O2/c1-4-19(10-14(20)17-11(2)3)9-12-5-7-13(8-6-12)15(21)18-16/h5-8,11H,4,9-10,16H2,1-3H3,(H,17,20)(H,18,21)
InChIKeyXPQLWSRLCDOGFL-UHFFFAOYSA-N
XLogP0.64
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[ethyl-[(4-fluorophenyl)methyl]amino]-N-propan-2-ylacetamide
CID 78791314
2-[(3-amino-4-hydroxyphenyl)methyl-ethylamino]-N-propan-2-ylacetamide
CID 54985803
4-[[ethyl(2-hydroxyethyl)amino]methyl]benzohydrazide
CID 63572832
4-[[ethyl(propan-2-yl)amino]methyl]benzohydrazide
CID 63573634
2-[(4-aminophenyl)methyl-ethylamino]-N-pentan-2-ylacetamide
CID 61489645
2-[[4-(aminomethyl)-3-methoxyphenyl]methyl-ethylamino]-N-propan-2-ylacetamide
CID 106785344
4-[[butan-2-yl(methyl)amino]methyl]benzohydrazide
CID 63573814
2-[ethyl-[(6-hydrazinyl-2-pyridinyl)methyl]amino]-N-propan-2-ylacetamide
CID 79242850
2-[ethyl(pyridin-4-ylmethyl)amino]acetohydrazide
CID 63584522
2-[ethyl-[2-(4-iodophenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
CID 60679964
(2R)-2-[[4-[[ethyl(propyl)amino]methyl]benzoyl]amino]-3-methylbutanoic acid
CID 119368577
3-bromo-4-[[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]methyl]benzoic acid
CID 102767285

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide (CID 63584771) is 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)Cc1ccc(C(=O)NN)cc1.
What is the InChIKey of 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide?
The InChIKey is XPQLWSRLCDOGFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-4-19(10-14(20)17-11(2)3)9-12-5-7-13(8-6-12)15(21)18-16/h5-8,11H,4,9-10,16H2,1-3H3,(H,17,20)(H,18,21).
What are the key properties of 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide?
2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide has a molecular weight of 292.38 g/mol, XLogP of 0.64, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[[4-(hydrazinecarbonyl)phenyl]methyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 63584771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).