1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide

C13H23N5O — CID 63757859

IUPAC1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide
SMILESCc1nn(C)c(NC(C)C2CCCNC2)c1C(N)=O
InChIInChI=1S/C13H23N5O/c1-8(10-5-4-6-15-7-10)16-13-11(12(14)19)9(2)17-18(13)3/h8,10,15-16H,4-7H2,1-3H3,(H2,14,19)
InChIKeyFHSCOLGNWPZMIO-UHFFFAOYSA-N
MW265.36 g/mol
LogP0.63
Rot. Bonds4

About 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide

1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide (PubChem CID 63757859) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide
PubChem CID63757859
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide
SMILESCc1nn(C)c(NC(C)C2CCCNC2)c1C(N)=O
InChIInChI=1S/C13H23N5O/c1-8(10-5-4-6-15-7-10)16-13-11(12(14)19)9(2)17-18(13)3/h8,10,15-16H,4-7H2,1-3H3,(H2,14,19)
InChIKeyFHSCOLGNWPZMIO-UHFFFAOYSA-N
XLogP0.63
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 50.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carbonitrile
CID 63758031
4,6-dimethyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide
CID 62047083
1,3-dimethyl-5-piperidin-3-yloxypyrazole-4-carboxamide
CID 55241527
3-(1-piperidin-3-ylethylamino)pyrazine-2-carboxamide
CID 62685001
6-methyl-2-(1-piperidin-3-ylethylamino)pyridine-3-carboxamide
CID 62047261
2-bromo-6-(1-piperidin-3-ylethylamino)benzamide
CID 114884744
1,3-dimethyl-5-(piperidin-4-ylmethylamino)pyrazole-4-carboxamide
CID 63757516
1,3-dimethyl-5-(piperidin-2-ylmethylamino)pyrazole-4-carboxamide
CID 63757179
1,3-dimethyl-5-(2-piperidin-3-ylethoxy)pyrazole-4-carboxamide
CID 63757545
3,5-dimethyl-N-(1-piperidin-3-ylethyl)-1,2-oxazole-4-carboxamide;hydrochloride
CID 119473975
5-[3-(cyclopropylamino)propylamino]-1,3-dimethylpyrazole-4-carboxamide
CID 63757857
2-amino-N-(1-piperidin-3-ylethyl)propanamide
CID 131134166

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide?
The IUPAC name of 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide (CID 63757859) is 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide.
What is the SMILES notation for 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide?
The canonical SMILES for 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide is Cc1nn(C)c(NC(C)C2CCCNC2)c1C(N)=O.
What is the InChIKey of 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide?
The InChIKey is FHSCOLGNWPZMIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-8(10-5-4-6-15-7-10)16-13-11(12(14)19)9(2)17-18(13)3/h8,10,15-16H,4-7H2,1-3H3,(H2,14,19).
What are the key properties of 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide?
1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide has a molecular weight of 265.36 g/mol, XLogP of 0.63, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-5-(1-piperidin-3-ylethylamino)pyrazole-4-carboxamide is sourced from PubChem (CID 63757859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).