N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide

C11H17N5O — CID 71892869

IUPACN-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide
SMILESO=C(NCCNc1cnccn1)N1CCCC1
InChIInChI=1S/C11H17N5O/c17-11(16-7-1-2-8-16)15-6-5-14-10-9-12-3-4-13-10/h3-4,9H,1-2,5-8H2,(H,13,14)(H,15,17)
InChIKeyQLGLQFXLMQQSBK-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.69
Rot. Bonds4

About N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide

N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide (PubChem CID 71892869) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide
PubChem CID71892869
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC NameN-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide
SMILESO=C(NCCNc1cnccn1)N1CCCC1
InChIInChI=1S/C11H17N5O/c17-11(16-7-1-2-8-16)15-6-5-14-10-9-12-3-4-13-10/h3-4,9H,1-2,5-8H2,(H,13,14)(H,15,17)
InChIKeyQLGLQFXLMQQSBK-UHFFFAOYSA-N
XLogP0.69
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
CID 66864122
6-(Pyrrolidin-1-yl)pyrazin-2-amine
CID 66520349
N-cyclopropyl-4-pyrazin-2-ylpiperazine-1-carboxamide
CID 33384005
N-(2-methylpropyl)-4-pyrazin-2-ylpiperazine-1-carboxamide
CID 33384049
N-butyl-2-ethylimidazole-1-carboxamide
CID 44306049
N-butyl-2-methylimidazole-1-carboxamide
CID 44306463
N-[2-(pyrazin-2-ylamino)ethyl]azepane-1-carboxamide
CID 53500608
4-acetyl-N-[2-(pyrazin-2-ylamino)ethyl]-1,4-diazepane-1-carboxamide
CID 53504842
4-methyl-N-[2-(pyrazin-2-ylamino)ethyl]-1,4-diazepane-1-carboxamide
CID 53505989
N-[2-(pyrazin-2-ylamino)ethyl]-3-pyrrolidin-1-ylpiperidine-1-carboxamide
CID 53522071
N-(3-imidazol-1-ylpropyl)-2,4-dimethylpiperazine-1-carboxamide
CID 71877025
4-(2-(1H-imidazol-1-yl)ethyl)-N-cyclohexylpiperazine-1-carboxamide
CID 71788601

Frequently Asked Questions

What is the IUPAC name of N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide (CID 71892869) is N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide is O=C(NCCNc1cnccn1)N1CCCC1.
What is the InChIKey of N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide?
The InChIKey is QLGLQFXLMQQSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c17-11(16-7-1-2-8-16)15-6-5-14-10-9-12-3-4-13-10/h3-4,9H,1-2,5-8H2,(H,13,14)(H,15,17).
What are the key properties of N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide?
N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide has a molecular weight of 235.29 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(pyrazin-2-ylamino)ethyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 71892869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).