3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide

C19H24N4O2 — CID 131890072

IUPAC3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide
SMILESCc1cc(C(=O)N2CCCC2)ccc1NC(=O)CCc1ccnn1C
InChIInChI=1S/C19H24N4O2/c1-14-13-15(19(25)23-11-3-4-12-23)5-7-17(14)21-18(24)8-6-16-9-10-20-22(16)2/h5,7,9-10,13H,3-4,6,8,11-12H2,1-2H3,(H,21,24)
InChIKeyOQEZDPTWJZLSOX-UHFFFAOYSA-N
MW340.43 g/mol
LogP2.54
Rot. Bonds5

About 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide

3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide (PubChem CID 131890072) has the molecular formula C19H24N4O2 and a molecular weight of 340.43 g/mol. Its IUPAC name is 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide
PubChem CID131890072
Molecular FormulaC19H24N4O2
Molecular Weight340.43 g/mol
Exact Mass340.19
IUPAC Name3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide
SMILESCc1cc(C(=O)N2CCCC2)ccc1NC(=O)CCc1ccnn1C
InChIInChI=1S/C19H24N4O2/c1-14-13-15(19(25)23-11-3-4-12-23)5-7-17(14)21-18(24)8-6-16-9-10-20-22(16)2/h5,7,9-10,13H,3-4,6,8,11-12H2,1-2H3,(H,21,24)
InChIKeyOQEZDPTWJZLSOX-UHFFFAOYSA-N
XLogP2.54
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.43
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The IUPAC name of 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide (CID 131890072) is 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide.
What is the SMILES notation for 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The canonical SMILES for 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide is Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)CCc1ccnn1C.
What is the InChIKey of 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
The InChIKey is OQEZDPTWJZLSOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O2/c1-14-13-15(19(25)23-11-3-4-12-23)5-7-17(14)21-18(24)8-6-16-9-10-20-22(16)2/h5,7,9-10,13H,3-4,6,8,11-12H2,1-2H3,(H,21,24).
What are the key properties of 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide?
3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide has a molecular weight of 340.43 g/mol, XLogP of 2.54, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylpyrazol-3-yl)-N-[2-methyl-4-(pyrrolidine-1-carbonyl)phenyl]propanamide is sourced from PubChem (CID 131890072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).