1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide

C15H26N4O — CID 106611340

IUPAC1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide
SMILESCc1c(C(=O)N(CC(C)C)CC2CCCN2)cnn1C
InChIInChI=1S/C15H26N4O/c1-11(2)9-19(10-13-6-5-7-16-13)15(20)14-8-17-18(4)12(14)3/h8,11,13,16H,5-7,9-10H2,1-4H3
InChIKeyROONEIARWQUOIW-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.58
Rot. Bonds5

About 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide

1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide (PubChem CID 106611340) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide
PubChem CID106611340
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide
SMILESCc1c(C(=O)N(CC(C)C)CC2CCCN2)cnn1C
InChIInChI=1S/C15H26N4O/c1-11(2)9-19(10-13-6-5-7-16-13)15(20)14-8-17-18(4)12(14)3/h8,11,13,16H,5-7,9-10H2,1-4H3
InChIKeyROONEIARWQUOIW-UHFFFAOYSA-N
XLogP1.58
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)thiophene-3-carboxamide
CID 106610939
2,4-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611361
2,3-difluoro-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611182
3,4-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611087
3-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106611115
5-bromo-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyridine-2-carboxamide
CID 106611118
5-bromo-2-fluoro-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611177
N-(2-methylpropyl)-6-oxo-N-(pyrrolidin-2-ylmethyl)pyran-3-carboxamide
CID 106611351
4-fluoro-3-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)benzamide
CID 106611187
5-ethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)thiophene-2-carboxamide
CID 106610975
N-(2-methylpropyl)-2-methylsulfonyl-N-(pyrrolidin-2-ylmethyl)propanamide
CID 106611302
1-ethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)cyclopentane-1-carboxamide
CID 106611291

Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide?
The IUPAC name of 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide (CID 106611340) is 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide.
What is the SMILES notation for 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide?
The canonical SMILES for 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide is Cc1c(C(=O)N(CC(C)C)CC2CCCN2)cnn1C.
What is the InChIKey of 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide?
The InChIKey is ROONEIARWQUOIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-11(2)9-19(10-13-6-5-7-16-13)15(20)14-8-17-18(4)12(14)3/h8,11,13,16H,5-7,9-10H2,1-4H3.
What are the key properties of 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide?
1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 1.58, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)pyrazole-4-carboxamide is sourced from PubChem (CID 106611340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).