1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide

C11H17N5O — CID 79259460

IUPAC1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
SMILESNNc1ccnc(CN2CCCC2C(N)=O)c1
InChIInChI=1S/C11H17N5O/c12-11(17)10-2-1-5-16(10)7-9-6-8(15-13)3-4-14-9/h3-4,6,10H,1-2,5,7,13H2,(H2,12,17)(H,14,15)
InChIKeyVEYOGXUXMLXHNH-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.18
Rot. Bonds4

About 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide

1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide (PubChem CID 79259460) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
PubChem CID79259460
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
SMILESNNc1ccnc(CN2CCCC2C(N)=O)c1
InChIInChI=1S/C11H17N5O/c12-11(17)10-2-1-5-16(10)7-9-6-8(15-13)3-4-14-9/h3-4,6,10H,1-2,5,7,13H2,(H2,12,17)(H,14,15)
InChIKeyVEYOGXUXMLXHNH-UHFFFAOYSA-N
XLogP-0.18
TPSA97.27 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.18
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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Frequently Asked Questions

What is the IUPAC name of 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide (CID 79259460) is 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide is NNc1ccnc(CN2CCCC2C(N)=O)c1.
What is the InChIKey of 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
The InChIKey is VEYOGXUXMLXHNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c12-11(17)10-2-1-5-16(10)7-9-6-8(15-13)3-4-14-9/h3-4,6,10H,1-2,5,7,13H2,(H2,12,17)(H,14,15).
What are the key properties of 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide?
1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide has a molecular weight of 235.29 g/mol, XLogP of -0.18, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-hydrazinyl-2-pyridinyl)methyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 79259460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).