2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide

C11H14N6O — CID 64519698

IUPAC2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
SMILESCN(Cc1ncc[nH]1)C(=O)c1ccnc(NN)c1
InChIInChI=1S/C11H14N6O/c1-17(7-10-14-4-5-15-10)11(18)8-2-3-13-9(6-8)16-12/h2-6H,7,12H2,1H3,(H,13,16)(H,14,15)
InChIKeyPCWZABVXVZNWRO-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.36
Rot. Bonds4

About 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide

2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide (PubChem CID 64519698) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
PubChem CID64519698
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
SMILESCN(Cc1ncc[nH]1)C(=O)c1ccnc(NN)c1
InChIInChI=1S/C11H14N6O/c1-17(7-10-14-4-5-15-10)11(18)8-2-3-13-9(6-8)16-12/h2-6H,7,12H2,1H3,(H,13,16)(H,14,15)
InChIKeyPCWZABVXVZNWRO-UHFFFAOYSA-N
XLogP0.36
TPSA99.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

2-fluoro-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide
CID 63929110
3-chloro-6-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-2-carboxamide
CID 64516802
N-[(4-bromophenyl)methyl]-2-hydrazinyl-N-methylpyridine-4-carboxamide
CID 62243894
3-[1H-imidazol-2-ylmethyl(methyl)carbamoyl]benzoic acid
CID 64516965
2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-sulfonamide
CID 64518479
2-hydrazinyl-N,N-dimethylpyridine-4-carboxamide
CID 62236400
4-[1H-imidazol-2-ylmethyl(methyl)carbamoyl]benzoic acid
CID 64519669
3-(dimethylamino)-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide
CID 63928901
2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylbenzamide
CID 64516996
3-chloro-N-(1H-imidazol-2-ylmethyl)-4-iodo-N-methylbenzamide
CID 103736159
N-[(3-chlorophenyl)methyl]-2-hydrazinyl-N-methylpyridine-4-carboxamide
CID 62236819
6-amino-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-3-carboxamide
CID 64519117

Frequently Asked Questions

What is the IUPAC name of 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide?
The IUPAC name of 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide (CID 64519698) is 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide.
What is the SMILES notation for 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide?
The canonical SMILES for 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide is CN(Cc1ncc[nH]1)C(=O)c1ccnc(NN)c1.
What is the InChIKey of 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide?
The InChIKey is PCWZABVXVZNWRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c1-17(7-10-14-4-5-15-10)11(18)8-2-3-13-9(6-8)16-12/h2-6H,7,12H2,1H3,(H,13,16)(H,14,15).
What are the key properties of 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide?
2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 0.36, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydrazinyl-N-(1H-imidazol-2-ylmethyl)-N-methylpyridine-4-carboxamide is sourced from PubChem (CID 64519698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).