4-methylpiperidine-2-carbohydrazide

C7H15N3O — CID 114424068

IUPAC4-methylpiperidine-2-carbohydrazide
SMILESCC1CCNC(C(=O)NN)C1
InChIInChI=1S/C7H15N3O/c1-5-2-3-9-6(4-5)7(11)10-8/h5-6,9H,2-4,8H2,1H3,(H,10,11)
InChIKeyBJCQFHBVWMWTNS-UHFFFAOYSA-N
MW157.22 g/mol
LogP-0.64
Rot. Bonds1

About 4-methylpiperidine-2-carbohydrazide

4-methylpiperidine-2-carbohydrazide (PubChem CID 114424068) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 4-methylpiperidine-2-carbohydrazide.

Molecular Properties

Compound Name4-methylpiperidine-2-carbohydrazide
PubChem CID114424068
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name4-methylpiperidine-2-carbohydrazide
SMILESCC1CCNC(C(=O)NN)C1
InChIInChI=1S/C7H15N3O/c1-5-2-3-9-6(4-5)7(11)10-8/h5-6,9H,2-4,8H2,1H3,(H,10,11)
InChIKeyBJCQFHBVWMWTNS-UHFFFAOYSA-N
XLogP-0.64
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-0.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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

N',N',4-trimethylpiperidine-2-carbohydrazide
CID 114424419
4-methyl-N-methylsulfonylpiperidine-2-carboxamide
CID 103287766
N-[2-(carbamoylamino)ethyl]-4-methylpiperidine-2-carboxamide
CID 114424437
N-(1-cyclopropylethyl)-4-methylpiperidine-2-carboxamide
CID 114422825
(2S,4S)-4-methylpiperidine-2-carboxylic acid;(2R,4R)-4-methylpiperidine-2-carboxylic acid;dihydrochloride
CID 171921042
N-(2-ethylbutyl)-4-methylpiperidine-2-carboxamide
CID 114424587
4-methyl-N-[(4-methylcyclohexyl)methyl]piperidine-2-carboxamide
CID 114424006
N-(2,2-dichloroethyl)-4-methylpiperidine-2-carboxamide
CID 130551928
3-methyl-3-[(4-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 113342121
3-methyl-2-[(4-methylpiperidine-2-carbonyl)amino]butanoic acid
CID 115866989
4-methyl-N-(2-methyloxolan-3-yl)piperidine-2-carboxamide
CID 114424400
4-methyl-N-(3-methylbut-2-enyl)piperidine-2-carboxamide
CID 106186997

Frequently Asked Questions

What is the IUPAC name of 4-methylpiperidine-2-carbohydrazide?
The IUPAC name of 4-methylpiperidine-2-carbohydrazide (CID 114424068) is 4-methylpiperidine-2-carbohydrazide.
What is the SMILES notation for 4-methylpiperidine-2-carbohydrazide?
The canonical SMILES for 4-methylpiperidine-2-carbohydrazide is CC1CCNC(C(=O)NN)C1.
What is the InChIKey of 4-methylpiperidine-2-carbohydrazide?
The InChIKey is BJCQFHBVWMWTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-5-2-3-9-6(4-5)7(11)10-8/h5-6,9H,2-4,8H2,1H3,(H,10,11).
What are the key properties of 4-methylpiperidine-2-carbohydrazide?
4-methylpiperidine-2-carbohydrazide has a molecular weight of 157.22 g/mol, XLogP of -0.64, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylpiperidine-2-carbohydrazide is sourced from PubChem (CID 114424068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).