2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide

C10H18N4O — CID 81478587

IUPAC2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide
SMILESCNCC(C)CNC(=O)c1ccnn1C
InChIInChI=1S/C10H18N4O/c1-8(6-11-2)7-12-10(15)9-4-5-13-14(9)3/h4-5,8,11H,6-7H2,1-3H3,(H,12,15)
InChIKeyDBVQDARQIYEWBF-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.01
Rot. Bonds5

About 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide

2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide (PubChem CID 81478587) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide
PubChem CID81478587
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide
SMILESCNCC(C)CNC(=O)c1ccnn1C
InChIInChI=1S/C10H18N4O/c1-8(6-11-2)7-12-10(15)9-4-5-13-14(9)3/h4-5,8,11H,6-7H2,1-3H3,(H,12,15)
InChIKeyDBVQDARQIYEWBF-UHFFFAOYSA-N
XLogP0.01
TPSA58.95 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide?
The IUPAC name of 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide (CID 81478587) is 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide?
The canonical SMILES for 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide is CNCC(C)CNC(=O)c1ccnn1C.
What is the InChIKey of 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide?
The InChIKey is DBVQDARQIYEWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-8(6-11-2)7-12-10(15)9-4-5-13-14(9)3/h4-5,8,11H,6-7H2,1-3H3,(H,12,15).
What are the key properties of 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide?
2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.01, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-methyl-3-(methylamino)propyl]pyrazole-3-carboxamide is sourced from PubChem (CID 81478587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).