(2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide

C10H15N5O2 — CID 69110422

IUPAC(2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide
SMILESCc1cc(NC(=O)N2CCC[C@H]2C(N)=O)n[nH]1
InChIInChI=1S/C10H15N5O2/c1-6-5-8(14-13-6)12-10(17)15-4-2-3-7(15)9(11)16/h5,7H,2-4H2,1H3,(H2,11,16)(H2,12,13,14,17)/t7-/m0/s1
InChIKeyDHWUZFKNFRIPJB-ZETCQYMHSA-N
MW237.26 g/mol
LogP0.20
Rot. Bonds2

About (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide

(2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide (PubChem CID 69110422) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide.

Molecular Properties

Compound Name(2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide
PubChem CID69110422
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC Name(2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide
SMILESCc1cc(NC(=O)N2CCC[C@H]2C(N)=O)n[nH]1
InChIInChI=1S/C10H15N5O2/c1-6-5-8(14-13-6)12-10(17)15-4-2-3-7(15)9(11)16/h5,7H,2-4H2,1H3,(H2,11,16)(H2,12,13,14,17)/t7-/m0/s1
InChIKeyDHWUZFKNFRIPJB-ZETCQYMHSA-N
XLogP0.20
TPSA104.11 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 50.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide?
The IUPAC name of (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide (CID 69110422) is (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide.
What is the SMILES notation for (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide?
The canonical SMILES for (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide is Cc1cc(NC(=O)N2CCC[C@H]2C(N)=O)n[nH]1.
What is the InChIKey of (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide?
The InChIKey is DHWUZFKNFRIPJB-ZETCQYMHSA-N. The full InChI is InChI=1S/C10H15N5O2/c1-6-5-8(14-13-6)12-10(17)15-4-2-3-7(15)9(11)16/h5,7H,2-4H2,1H3,(H2,11,16)(H2,12,13,14,17)/t7-/m0/s1.
What are the key properties of (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide?
(2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide has a molecular weight of 237.26 g/mol, XLogP of 0.20, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1-N-(5-methyl-1H-pyrazol-3-yl)pyrrolidine-1,2-dicarboxamide is sourced from PubChem (CID 69110422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).