3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide

C12H19N5O — CID 139313951

IUPAC3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide
SMILESCC1CCN(C(=O)NNc2cnccn2)CC1C
InChIInChI=1S/C12H19N5O/c1-9-3-6-17(8-10(9)2)12(18)16-15-11-7-13-4-5-14-11/h4-5,7,9-10H,3,6,8H2,1-2H3,(H,14,15)(H,16,18)
InChIKeyHSNSJCAXMIWRDV-UHFFFAOYSA-N
MW249.32 g/mol
LogP1.49
Rot. Bonds2

About 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide

3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide (PubChem CID 139313951) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide.

Molecular Properties

Compound Name3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide
PubChem CID139313951
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide
SMILESCC1CCN(C(=O)NNc2cnccn2)CC1C
InChIInChI=1S/C12H19N5O/c1-9-3-6-17(8-10(9)2)12(18)16-15-11-7-13-4-5-14-11/h4-5,7,9-10H,3,6,8H2,1-2H3,(H,14,15)(H,16,18)
InChIKeyHSNSJCAXMIWRDV-UHFFFAOYSA-N
XLogP1.49
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3,5-dimethyl-N-pyrazin-2-ylpiperidine-1-carboxamide
CID 108893834
1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide
CID 110492224
(3R,4R)-4-methyl-N-pyrazin-2-yl-3-(1,5,7,11-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl)piperidine-1-carboxamide
CID 67999696
N-[2-[[(3R,4R)-3,4-dimethylpiperidine-1-carbonyl]amino]ethyl]pyridine-3-carboxamide
CID 124595352
tert-butyl (3S)-3-[(pyrazin-2-ylamino)methyl]pyrrolidine-1-carboxylate
CID 97171199
N-pyrazin-2-ylpyrrolidine-1-carboxamide
CID 110492109
2-methoxy-N'-pyrazin-2-ylacetohydrazide
CID 131086355
N-pyrazin-2-ylazepane-1-carboxamide
CID 110492146
prop-1-en-2-yl (3R)-3-(pyrazin-2-ylamino)pyrrolidine-1-carboxylate
CID 89068665
2-methyl-1-[(3R)-3-(pyrazin-2-ylamino)piperidin-1-yl]propan-1-one
CID 125437337
(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone
CID 107376989
cyclopropyl-(3,4-dimethylpiperidin-1-yl)methanone
CID 21061776

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide?
The IUPAC name of 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide (CID 139313951) is 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide.
What is the SMILES notation for 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide?
The canonical SMILES for 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide is CC1CCN(C(=O)NNc2cnccn2)CC1C.
What is the InChIKey of 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide?
The InChIKey is HSNSJCAXMIWRDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-9-3-6-17(8-10(9)2)12(18)16-15-11-7-13-4-5-14-11/h4-5,7,9-10H,3,6,8H2,1-2H3,(H,14,15)(H,16,18).
What are the key properties of 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide?
3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide has a molecular weight of 249.32 g/mol, XLogP of 1.49, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N'-pyrazin-2-ylpiperidine-1-carbohydrazide is sourced from PubChem (CID 139313951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).