1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide

C11H17N5O2 — CID 62082683

IUPAC1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide
SMILESCCc1[nH]nc(C(=O)N2CCCC2C(N)=O)c1N
InChIInChI=1S/C11H17N5O2/c1-2-6-8(12)9(15-14-6)11(18)16-5-3-4-7(16)10(13)17/h7H,2-5,12H2,1H3,(H2,13,17)(H,14,15)
InChIKeyPSWZMLALJRBEAV-UHFFFAOYSA-N
MW251.29 g/mol
LogP-0.36
Rot. Bonds3

About 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide

1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide (PubChem CID 62082683) has the molecular formula C11H17N5O2 and a molecular weight of 251.29 g/mol. Its IUPAC name is 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide
PubChem CID62082683
Molecular FormulaC11H17N5O2
Molecular Weight251.29 g/mol
Exact Mass251.14
IUPAC Name1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide
SMILESCCc1[nH]nc(C(=O)N2CCCC2C(N)=O)c1N
InChIInChI=1S/C11H17N5O2/c1-2-6-8(12)9(15-14-6)11(18)16-5-3-4-7(16)10(13)17/h7H,2-5,12H2,1H3,(H2,13,17)(H,14,15)
InChIKeyPSWZMLALJRBEAV-UHFFFAOYSA-N
XLogP-0.36
TPSA118.10 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide (CID 62082683) is 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide is CCc1[nH]nc(C(=O)N2CCCC2C(N)=O)c1N.
What is the InChIKey of 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide?
The InChIKey is PSWZMLALJRBEAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O2/c1-2-6-8(12)9(15-14-6)11(18)16-5-3-4-7(16)10(13)17/h7H,2-5,12H2,1H3,(H2,13,17)(H,14,15).
What are the key properties of 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide?
1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide has a molecular weight of 251.29 g/mol, XLogP of -0.36, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-5-ethyl-1H-pyrazole-3-carbonyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 62082683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).