4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide

C13H24N4O — CID 66123658

IUPAC4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide
SMILESCCCN(CCC)C(=O)c1c(N)c(C)nn1CC
InChIInChI=1S/C13H24N4O/c1-5-8-16(9-6-2)13(18)12-11(14)10(4)15-17(12)7-3/h5-9,14H2,1-4H3
InChIKeyJDDJPBOCEOEHTH-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.06
Rot. Bonds6

About 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide

4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide (PubChem CID 66123658) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide
PubChem CID66123658
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC Name4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide
SMILESCCCN(CCC)C(=O)c1c(N)c(C)nn1CC
InChIInChI=1S/C13H24N4O/c1-5-8-16(9-6-2)13(18)12-11(14)10(4)15-17(12)7-3/h5-9,14H2,1-4H3
InChIKeyJDDJPBOCEOEHTH-UHFFFAOYSA-N
XLogP2.06
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N-(2-amino-2-oxoethyl)-N-butyl-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66123685
4-amino-1-ethyl-N-(1-hydroxypropan-2-yl)-N,3-dimethylpyrazole-5-carboxamide
CID 104550920
4-amino-1-ethyl-N-(3-hydroxypropyl)-3-methyl-N-propan-2-ylpyrazole-5-carboxamide
CID 66123112
4-amino-1-ethyl-N,3-dimethyl-N-phenylpyrazole-5-carboxamide
CID 66123079
4-amino-1-ethyl-N-[2-[ethyl(methyl)amino]ethyl]-3-methylpyrazole-5-carboxamide
CID 66125449
4-amino-1-ethyl-N-(2-methoxyethyl)-3-methyl-N-pentan-3-ylpyrazole-5-carboxamide
CID 66123490
4-amino-N-cyclopropyl-N-(cyclopropylmethyl)-1-ethyl-3-methylpyrazole-5-carboxamide
CID 66125071
4-amino-1-ethyl-N-hexyl-3-methylpyrazole-5-carboxamide
CID 66124652
2-(4-amino-3,5-dimethylpyrazol-1-yl)-N-(2-hydroxyethyl)-N-propylacetamide
CID 61105427
methyl 3-[(4-amino-1-ethyl-3-methylpyrazole-5-carbonyl)-methylamino]-2-methylpropanoate
CID 66123492
(4-amino-1-ethyl-3-methylpyrazol-5-yl)-(4-methylpiperazin-1-yl)methanone
CID 66125786
4-amino-1-ethyl-N-[(4-fluorophenyl)methyl]-N,3-dimethylpyrazole-5-carboxamide
CID 66122905

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide (CID 66123658) is 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide is CCCN(CCC)C(=O)c1c(N)c(C)nn1CC.
What is the InChIKey of 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide?
The InChIKey is JDDJPBOCEOEHTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-5-8-16(9-6-2)13(18)12-11(14)10(4)15-17(12)7-3/h5-9,14H2,1-4H3.
What are the key properties of 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide?
4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide has a molecular weight of 252.36 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-3-methyl-N,N-dipropylpyrazole-5-carboxamide is sourced from PubChem (CID 66123658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).