5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide

C11H21N5O — CID 82546931

IUPAC5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide
SMILESCCN(CC)CCNC(=O)c1cnn(C)c1N
InChIInChI=1S/C11H21N5O/c1-4-16(5-2)7-6-13-11(17)9-8-14-15(3)10(9)12/h8H,4-7,12H2,1-3H3,(H,13,17)
InChIKeyKUADTXVVKNGBCN-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.07
Rot. Bonds6

About 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide

5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide (PubChem CID 82546931) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide
PubChem CID82546931
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide
SMILESCCN(CC)CCNC(=O)c1cnn(C)c1N
InChIInChI=1S/C11H21N5O/c1-4-16(5-2)7-6-13-11(17)9-8-14-15(3)10(9)12/h8H,4-7,12H2,1-3H3,(H,13,17)
InChIKeyKUADTXVVKNGBCN-UHFFFAOYSA-N
XLogP0.07
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-amino-N-butyl-1-methylpyrazole-4-carboxamide
CID 80503275
5-amino-N-[5-(diethylamino)pentan-2-yl]-1-methylpyrazole-4-carboxamide
CID 115330341
5-amino-N-(3-amino-3-oxopropyl)-1-methylpyrazole-4-carboxamide
CID 115330437
5-amino-N-[2-[ethyl(methyl)amino]-2-oxoethyl]-1-methylpyrazole-4-carboxamide
CID 104928029
5-amino-N-(3-methoxypropyl)-1-methylpyrazole-4-carboxamide
CID 82547322
5-amino-N-[2-(2-amino-2-oxoethoxy)ethyl]-1-methylpyrazole-4-carboxamide
CID 104592175
5-amino-1-methyl-N-(3-methylsulfonylpropyl)pyrazole-4-carboxamide
CID 115330667
5-amino-N-[2-(dimethylamino)propyl]-1-methylpyrazole-4-carboxamide
CID 115330694
5-amino-N-[2-(2-methoxyethoxy)ethyl]-1-methylpyrazole-4-carboxamide
CID 115330672
5-amino-1-methyl-N-[2-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrazole-4-carboxamide
CID 82546172
5-amino-1-methyl-N-(2-pyridin-4-ylethyl)pyrazole-4-carboxamide
CID 115330468
5-amino-N-[4-(2-methoxyethoxy)butyl]-1-methylpyrazole-4-carboxamide
CID 104587708

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide?
The IUPAC name of 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide (CID 82546931) is 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide is CCN(CC)CCNC(=O)c1cnn(C)c1N.
What is the InChIKey of 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide?
The InChIKey is KUADTXVVKNGBCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-4-16(5-2)7-6-13-11(17)9-8-14-15(3)10(9)12/h8H,4-7,12H2,1-3H3,(H,13,17).
What are the key properties of 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide?
5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide has a molecular weight of 239.32 g/mol, XLogP of 0.07, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[2-(diethylamino)ethyl]-1-methylpyrazole-4-carboxamide is sourced from PubChem (CID 82546931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).