2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide

C10H16N6O3 — CID 80894166

IUPAC2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN(C)c1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C10H16N6O3/c1-14(2)9(17)6-15(3)10-7(16(18)19)4-5-8(12-10)13-11/h4-5H,6,11H2,1-3H3,(H,12,13)
InChIKeyWABDNFSEGCVCBL-UHFFFAOYSA-N
MW268.28 g/mol
LogP-0.20
Rot. Bonds5

About 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide

2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide (PubChem CID 80894166) has the molecular formula C10H16N6O3 and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
PubChem CID80894166
Molecular FormulaC10H16N6O3
Molecular Weight268.28 g/mol
Exact Mass268.13
IUPAC Name2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide
SMILESCN(C)C(=O)CN(C)c1nc(NN)ccc1[N+](=O)[O-]
InChIInChI=1S/C10H16N6O3/c1-14(2)9(17)6-15(3)10-7(16(18)19)4-5-8(12-10)13-11/h4-5H,6,11H2,1-3H3,(H,12,13)
InChIKeyWABDNFSEGCVCBL-UHFFFAOYSA-N
XLogP-0.20
TPSA117.63 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

6-hydrazinyl-N-methyl-N-(2-methylsulfonylethyl)-3-nitropyridin-2-amine
CID 80929654
N-[(2-bromophenyl)methyl]-6-hydrazinyl-N-methyl-3-nitropyridin-2-amine
CID 80899980
2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-(2-hydroxyethyl)amino]ethanol
CID 80898902
N,N-dibutyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80916699
6-hydrazinyl-3-nitro-N-propan-2-yl-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 80902169
6-hydrazinyl-N-methyl-3-nitro-N-(oxolan-3-yl)pyridin-2-amine
CID 82747704
3-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]-3-methylbutanamide
CID 114143244
methyl 3-[(6-hydrazinyl-3-nitro-2-pyridinyl)amino]propanoate
CID 80899106
N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
3-[methyl-[6-(methylamino)-3-nitro-2-pyridinyl]amino]propanenitrile
CID 80753426
6-N-ethyl-2-N-methyl-3-nitro-2-N-pentylpyridine-2,6-diamine
CID 80782981
1-methoxy-3-[methyl-[6-(methylamino)-3-nitro-2-pyridinyl]amino]propan-2-ol
CID 80810495

Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
The IUPAC name of 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide (CID 80894166) is 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide.
What is the SMILES notation for 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
The canonical SMILES for 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide is CN(C)C(=O)CN(C)c1nc(NN)ccc1[N+](=O)[O-].
What is the InChIKey of 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
The InChIKey is WABDNFSEGCVCBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N6O3/c1-14(2)9(17)6-15(3)10-7(16(18)19)4-5-8(12-10)13-11/h4-5H,6,11H2,1-3H3,(H,12,13).
What are the key properties of 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide?
2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide has a molecular weight of 268.28 g/mol, XLogP of -0.20, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinyl-3-nitro-2-pyridinyl)-methylamino]-N,N-dimethylacetamide is sourced from PubChem (CID 80894166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).