2-methylpyrrolidine-3-carbohydrazide

C6H13N3O — CID 79384311

IUPAC2-methylpyrrolidine-3-carbohydrazide
SMILESCC1NCCC1C(=O)NN
InChIInChI=1S/C6H13N3O/c1-4-5(2-3-8-4)6(10)9-7/h4-5,8H,2-3,7H2,1H3,(H,9,10)
InChIKeyGDRAGFNMBOGJMN-UHFFFAOYSA-N
MW143.19 g/mol
LogP-1.03
Rot. Bonds1

About 2-methylpyrrolidine-3-carbohydrazide

2-methylpyrrolidine-3-carbohydrazide (PubChem CID 79384311) has the molecular formula C6H13N3O and a molecular weight of 143.19 g/mol. Its IUPAC name is 2-methylpyrrolidine-3-carbohydrazide.

Molecular Properties

Compound Name2-methylpyrrolidine-3-carbohydrazide
PubChem CID79384311
Molecular FormulaC6H13N3O
Molecular Weight143.19 g/mol
Exact Mass143.11
IUPAC Name2-methylpyrrolidine-3-carbohydrazide
SMILESCC1NCCC1C(=O)NN
InChIInChI=1S/C6H13N3O/c1-4-5(2-3-8-4)6(10)9-7/h4-5,8H,2-3,7H2,1H3,(H,9,10)
InChIKeyGDRAGFNMBOGJMN-UHFFFAOYSA-N
XLogP-1.03
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-1.03
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,2-dimethylpyrrolidine-3-carboxamide
CID 79382983
(2R,3R)-2-methylpyrrolidine-3-carboxylic acid
CID 10887930
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2-methylpyrrolidine-3-carboxamide
CID 79389113
2-[(2-methylpyrrolidine-3-carbonyl)amino]acetic acid
CID 79388783
ethyl 3-[(2-methylpyrrolidine-3-carbonyl)amino]propanoate
CID 79389205
ethyl (2S,3S)-2-methylpyrrolidine-3-carboxylate
CID 155921196
2-[(2-methylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 79388540
N-[4-(carbamoylamino)phenyl]-2-methylpyrrolidine-3-carboxamide
CID 79388750
2-hydroxy-2-methyl-3-[(2-methylpyrrolidine-3-carbonyl)amino]propanoic acid
CID 79385228
N-[2-(ethylamino)-2-oxoethyl]-2-methylpyrrolidine-3-carboxamide
CID 79388729
2-methyl-N-(2-methylbut-3-yn-2-yl)pyrrolidine-3-carboxamide
CID 79384521
2-methyl-N-(2-methylprop-2-enyl)pyrrolidine-3-carboxamide
CID 114617185

Frequently Asked Questions

What is the IUPAC name of 2-methylpyrrolidine-3-carbohydrazide?
The IUPAC name of 2-methylpyrrolidine-3-carbohydrazide (CID 79384311) is 2-methylpyrrolidine-3-carbohydrazide.
What is the SMILES notation for 2-methylpyrrolidine-3-carbohydrazide?
The canonical SMILES for 2-methylpyrrolidine-3-carbohydrazide is CC1NCCC1C(=O)NN.
What is the InChIKey of 2-methylpyrrolidine-3-carbohydrazide?
The InChIKey is GDRAGFNMBOGJMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13N3O/c1-4-5(2-3-8-4)6(10)9-7/h4-5,8H,2-3,7H2,1H3,(H,9,10).
What are the key properties of 2-methylpyrrolidine-3-carbohydrazide?
2-methylpyrrolidine-3-carbohydrazide has a molecular weight of 143.19 g/mol, XLogP of -1.03, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpyrrolidine-3-carbohydrazide is sourced from PubChem (CID 79384311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).