N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide

C15H17N5O2 — CID 138053865

IUPACN-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
SMILESCOCCc1cc(NC(=O)c2cc3cccn3cn2)n(C)n1
InChIInChI=1S/C15H17N5O2/c1-19-14(8-11(18-19)5-7-22-2)17-15(21)13-9-12-4-3-6-20(12)10-16-13/h3-4,6,8-10H,5,7H2,1-2H3,(H,17,21)
InChIKeyZAGFFYWTEVAFBU-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.51
Rot. Bonds5

About N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide

N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide (PubChem CID 138053865) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
PubChem CID138053865
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC NameN-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide
SMILESCOCCc1cc(NC(=O)c2cc3cccn3cn2)n(C)n1
InChIInChI=1S/C15H17N5O2/c1-19-14(8-11(18-19)5-7-22-2)17-15(21)13-9-12-4-3-6-20(12)10-16-13/h3-4,6,8-10H,5,7H2,1-2H3,(H,17,21)
InChIKeyZAGFFYWTEVAFBU-UHFFFAOYSA-N
XLogP1.51
TPSA73.45 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?
The IUPAC name of N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide (CID 138053865) is N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide.
What is the SMILES notation for N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?
The canonical SMILES for N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide is COCCc1cc(NC(=O)c2cc3cccn3cn2)n(C)n1.
What is the InChIKey of N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?
The InChIKey is ZAGFFYWTEVAFBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c1-19-14(8-11(18-19)5-7-22-2)17-15(21)13-9-12-4-3-6-20(12)10-16-13/h3-4,6,8-10H,5,7H2,1-2H3,(H,17,21).
What are the key properties of N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide?
N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide has a molecular weight of 299.33 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethyl)-1-methylpyrazol-5-yl]pyrrolo[1,2-c]pyrimidine-3-carboxamide is sourced from PubChem (CID 138053865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).