N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide

C14H24N4O — CID 61488987

IUPACN-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide
SMILESCCN(C(=O)Cn1nc(C)c(CNC)c1C)C1CC1
InChIInChI=1S/C14H24N4O/c1-5-17(12-6-7-12)14(19)9-18-11(3)13(8-15-4)10(2)16-18/h12,15H,5-9H2,1-4H3
InChIKeySGZGXIUYSLJXTE-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.23
Rot. Bonds6

About N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide

N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide (PubChem CID 61488987) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide
PubChem CID61488987
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC NameN-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide
SMILESCCN(C(=O)Cn1nc(C)c(CNC)c1C)C1CC1
InChIInChI=1S/C14H24N4O/c1-5-17(12-6-7-12)14(19)9-18-11(3)13(8-15-4)10(2)16-18/h12,15H,5-9H2,1-4H3
InChIKeySGZGXIUYSLJXTE-UHFFFAOYSA-N
XLogP1.23
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide?
The IUPAC name of N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide (CID 61488987) is N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide.
What is the SMILES notation for N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide?
The canonical SMILES for N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide is CCN(C(=O)Cn1nc(C)c(CNC)c1C)C1CC1.
What is the InChIKey of N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide?
The InChIKey is SGZGXIUYSLJXTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-17(12-6-7-12)14(19)9-18-11(3)13(8-15-4)10(2)16-18/h12,15H,5-9H2,1-4H3.
What are the key properties of N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide?
N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide has a molecular weight of 264.37 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3,5-dimethyl-4-(methylaminomethyl)pyrazol-1-yl]-N-ethylacetamide is sourced from PubChem (CID 61488987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).