1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide

C12H24N4O2 — CID 79631814

IUPAC1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CC(C)(C)C(=O)NN)CC1
InChIInChI=1S/C12H24N4O2/c1-12(2,11(18)15-13)8-16-6-4-9(5-7-16)10(17)14-3/h9H,4-8,13H2,1-3H3,(H,14,17)(H,15,18)
InChIKeyPBWIJCVTCDPNMQ-UHFFFAOYSA-N
MW256.35 g/mol
LogP-0.54
Rot. Bonds4

About 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide

1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide (PubChem CID 79631814) has the molecular formula C12H24N4O2 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide
PubChem CID79631814
Molecular FormulaC12H24N4O2
Molecular Weight256.35 g/mol
Exact Mass256.19
IUPAC Name1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide
SMILESCNC(=O)C1CCN(CC(C)(C)C(=O)NN)CC1
InChIInChI=1S/C12H24N4O2/c1-12(2,11(18)15-13)8-16-6-4-9(5-7-16)10(17)14-3/h9H,4-8,13H2,1-3H3,(H,14,17)(H,15,18)
InChIKeyPBWIJCVTCDPNMQ-UHFFFAOYSA-N
XLogP-0.54
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 5-0.54
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

3-(azocan-1-yl)-2,2-dimethylpropanehydrazide
CID 79627677
2,2-dimethyl-3-(4-methylazepan-1-yl)propanehydrazide
CID 79630412
3-[4-(cyclopropylmethyl)piperazin-1-yl]-2,2-dimethylpropanehydrazide
CID 79631258
2,2-dimethyl-3-(4-propan-2-ylazepan-1-yl)propanehydrazide
CID 79631643
1-(1,1-difluoro-2-hydrazinyl-2-oxoethyl)-N-methylpiperidine-4-carboxamide
CID 55213669
3-(4-acetylpiperazin-1-yl)-2,2-dimethylpropanehydrazide
CID 79628344
1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)piperidine-3-carboxamide
CID 79628715
N-[1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)pyrrolidin-3-yl]acetamide
CID 113402653
4-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylmorpholine-3-carboxamide
CID 83105959
3-(3,4-dimethylpyrrolidin-1-yl)-2,2-dimethylpropanehydrazide
CID 79631732
1-(4-hydrazinyl-4-oxobutyl)-N-methylpiperidine-4-carboxamide
CID 63584988
3-(8-azaspiro[4.5]decan-8-yl)-2,2-dimethylpropanehydrazide
CID 79628363

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide?
The IUPAC name of 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide (CID 79631814) is 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide is CNC(=O)C1CCN(CC(C)(C)C(=O)NN)CC1.
What is the InChIKey of 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide?
The InChIKey is PBWIJCVTCDPNMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O2/c1-12(2,11(18)15-13)8-16-6-4-9(5-7-16)10(17)14-3/h9H,4-8,13H2,1-3H3,(H,14,17)(H,15,18).
What are the key properties of 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide?
1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide has a molecular weight of 256.35 g/mol, XLogP of -0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydrazinyl-2,2-dimethyl-3-oxopropyl)-N-methylpiperidine-4-carboxamide is sourced from PubChem (CID 79631814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).