3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide

C15H27N5O — CID 75505198

IUPAC3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide
SMILESCCc1c(NC(=O)N2CC(N(C)C)C2)cnn1CC(C)C
InChIInChI=1S/C15H27N5O/c1-6-14-13(7-16-20(14)8-11(2)3)17-15(21)19-9-12(10-19)18(4)5/h7,11-12H,6,8-10H2,1-5H3,(H,17,21)
InChIKeyGEOFWCJIFDPMQX-UHFFFAOYSA-N
MW293.42 g/mol
LogP1.88
Rot. Bonds5

About 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide

3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide (PubChem CID 75505198) has the molecular formula C15H27N5O and a molecular weight of 293.42 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide
PubChem CID75505198
Molecular FormulaC15H27N5O
Molecular Weight293.42 g/mol
Exact Mass293.22
IUPAC Name3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide
SMILESCCc1c(NC(=O)N2CC(N(C)C)C2)cnn1CC(C)C
InChIInChI=1S/C15H27N5O/c1-6-14-13(7-16-20(14)8-11(2)3)17-15(21)19-9-12(10-19)18(4)5/h7,11-12H,6,8-10H2,1-5H3,(H,17,21)
InChIKeyGEOFWCJIFDPMQX-UHFFFAOYSA-N
XLogP1.88
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.42
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide?
The IUPAC name of 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide (CID 75505198) is 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide.
What is the SMILES notation for 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide?
The canonical SMILES for 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide is CCc1c(NC(=O)N2CC(N(C)C)C2)cnn1CC(C)C.
What is the InChIKey of 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide?
The InChIKey is GEOFWCJIFDPMQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5O/c1-6-14-13(7-16-20(14)8-11(2)3)17-15(21)19-9-12(10-19)18(4)5/h7,11-12H,6,8-10H2,1-5H3,(H,17,21).
What are the key properties of 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide?
3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide has a molecular weight of 293.42 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[5-ethyl-1-(2-methylpropyl)pyrazol-4-yl]azetidine-1-carboxamide is sourced from PubChem (CID 75505198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).