2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide

C13H22N4O2 — CID 103229759

IUPAC2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide
SMILESCCN(Cc1cccc(C)n1)C(COC)C(=O)NN
InChIInChI=1S/C13H22N4O2/c1-4-17(12(9-19-3)13(18)16-14)8-11-7-5-6-10(2)15-11/h5-7,12H,4,8-9,14H2,1-3H3,(H,16,18)
InChIKeyCXHQBEYWKXGXSA-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.22
Rot. Bonds7

About 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide

2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide (PubChem CID 103229759) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide.

Molecular Properties

Compound Name2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide
PubChem CID103229759
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide
SMILESCCN(Cc1cccc(C)n1)C(COC)C(=O)NN
InChIInChI=1S/C13H22N4O2/c1-4-17(12(9-19-3)13(18)16-14)8-11-7-5-6-10(2)15-11/h5-7,12H,4,8-9,14H2,1-3H3,(H,16,18)
InChIKeyCXHQBEYWKXGXSA-UHFFFAOYSA-N
XLogP0.22
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

3-Ethoxy-N-[1-(6-methylpyridin-2-YL)propyl]propanamide
CID 91777085
Trimethyl-[2-oxo-2-[2-(pyridin-2-ylmethyl)hydrazinyl]ethyl]azanium
CID 168300961
2-[6,14,17-Tris(2-hydrazinyl-2-oxoethyl)-3,6,14,17,23,24-hexazatricyclo[17.3.1.18,12]tetracosa-1(23),8(24),9,11,19,21-hexaen-3-yl]acetohydrazide
CID 102476630
4-(2,2-difluoroethyl)-N-[2-(6-methylpyridin-2-yl)ethyl]morpholine-3-carboxamide
CID 136538734
2-(dimethylamino)-N-[(E)-1-[6-[(E)-N-[[2-(dimethylamino)acetyl]amino]-C-methylcarbonimidoyl]-2-pyridinyl]ethylideneamino]acetamide
CID 10021494
2-(dimethylamino)-N-[(E)-1-[6-[(E)-N-[[2-(dimethylamino)acetyl]amino]-C-methylcarbonimidoyl]-2-pyridinyl]ethylideneamino]acetamide;dihydrochloride
CID 57422139
2,6-Diacetylpyridine bis(dimethylaminoacetylhydrazone) dihydrochloride
CID 76529714
2-(dimethylamino)-N-[1-[6-[N-[[2-(dimethylamino)acetyl]amino]-C-methylcarbonimidoyl]-2-pyridinyl]ethylideneamino]acetamide
CID 76529715
Methyl 2-(3,6,9,15-tetrazabicyclo[9.3.1]pentadeca-1(14),11(15),12-trien-3-yl)acetate
CID 129309450
(Z)-4-[amino(1,2-dihydropyridin-3-yl)amino]-N-(2-ethoxyethyl)-N-methyl-4-(6-methyl-2-pyridinyl)but-3-enamide
CID 142929816
N-[2-[ethyl(methyl)amino]ethyl]-2-[3-[(Z)-1-methoxybut-2-en-2-yl]iminoprop-1-en-2-yl]-3-(6-methyl-2-pyridinyl)-1,5-dihydropyrazole-5-carboxamide
CID 142929839
(2S)-2-[[(E)-[(Z)-3-amino-2-[(6-methyl-2-pyridinyl)methyl]prop-2-enylidene]carbamoyl]amino]-3-methoxy-N,N-dimethylpropanamide
CID 165121012

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide?
The IUPAC name of 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide (CID 103229759) is 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide.
What is the SMILES notation for 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide?
The canonical SMILES for 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide is CCN(Cc1cccc(C)n1)C(COC)C(=O)NN.
What is the InChIKey of 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide?
The InChIKey is CXHQBEYWKXGXSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-4-17(12(9-19-3)13(18)16-14)8-11-7-5-6-10(2)15-11/h5-7,12H,4,8-9,14H2,1-3H3,(H,16,18).
What are the key properties of 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide?
2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide has a molecular weight of 266.34 g/mol, XLogP of 0.22, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[(6-methyl-2-pyridinyl)methyl]amino]-3-methoxypropanehydrazide is sourced from PubChem (CID 103229759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).