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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Related Compounds

N-(cyclopropylmethyl)-2-[(3-ethyl-1-methylpyrazol-4-yl)carbamoylamino]acetamide
CID 75448424
1-[(1S)-1-(cyclohexen-1-yl)ethyl]-3-(1-ethyl-3-methylpyrazol-4-yl)urea
CID 97433597
3-cyano-N-[5-cyclopropyl-1-(2-methylpropyl)pyrazol-4-yl]-3-methylazetidine-1-carboxamide
CID 128404468
1-(2-Fluoroethyl)-3-(1-methyl-3-propan-2-ylpyrazol-4-yl)urea
CID 132384581
1-[2-(3,3-Dimethylpyrrolidin-1-yl)ethyl]-3-(1-methyl-3-propan-2-ylpyrazol-4-yl)urea
CID 138025189
N-(1-methyl-3-propan-2-ylpyrazol-4-yl)-4-[(2-oxoimidazolidin-1-yl)methyl]piperidine-1-carboxamide
CID 138025197
1-(3-ethyl-1-methylpyrazol-4-yl)-3-[[(1S,2S)-2-(trifluoromethyl)cyclopropyl]methyl]urea
CID 164629892
(5S)-N-(1-butyl-5-propan-2-ylpyrazol-4-yl)-1,7-diazaspiro[4.4]nonane-1-carboxamide
CID 164630927
3-[1-[(2S)-butan-2-yl]-5-methylpyrazol-4-yl]-1-ethyl-1-(2-methylprop-2-enyl)urea
CID 164631155
1-(3-ethyl-1-methylpyrazol-4-yl)-3-[2-[(3S)-1-methyl-5-oxopyrrolidin-3-yl]ethyl]urea
CID 164633933
(3S)-N-[5-cyclopropyl-1-(2-methylpropyl)pyrazol-4-yl]-3-methyl-4-oxopiperidine-1-carboxamide
CID 164641706
1-(3-Ethyl-1-methylpyrazol-4-yl)-3-(2,2,2-trifluoroethyl)urea
CID 103908572

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).