4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide

C11H21N5O — CID 65359893

IUPAC4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide
SMILESCC(CCN(C)C)NC(=O)c1c(N)cnn1C
InChIInChI=1S/C11H21N5O/c1-8(5-6-15(2)3)14-11(17)10-9(12)7-13-16(10)4/h7-8H,5-6,12H2,1-4H3,(H,14,17)
InChIKeyWMSACZMBMZMKPQ-UHFFFAOYSA-N
MW239.32 g/mol
LogP0.07
Rot. Bonds5

About 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide

4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide (PubChem CID 65359893) has the molecular formula C11H21N5O and a molecular weight of 239.32 g/mol. Its IUPAC name is 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide
PubChem CID65359893
Molecular FormulaC11H21N5O
Molecular Weight239.32 g/mol
Exact Mass239.17
IUPAC Name4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide
SMILESCC(CCN(C)C)NC(=O)c1c(N)cnn1C
InChIInChI=1S/C11H21N5O/c1-8(5-6-15(2)3)14-11(17)10-9(12)7-13-16(10)4/h7-8H,5-6,12H2,1-4H3,(H,14,17)
InChIKeyWMSACZMBMZMKPQ-UHFFFAOYSA-N
XLogP0.07
TPSA76.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
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 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-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

4-amino-N-hexan-2-yl-1-methylpyrazole-5-carboxamide
CID 65359999
4-amino-1-methyl-N-octan-2-ylpyrazole-5-carboxamide
CID 65359456
4-amino-N-(1-amino-1-oxopropan-2-yl)-1-methylpyrazole-5-carboxamide
CID 65355770
ethyl 2-[(4-amino-1-methylpyrazole-5-carbonyl)amino]propanoate
CID 65359556
4-amino-1-methyl-N-[1-(2-methylphenyl)propan-2-yl]pyrazole-5-carboxamide
CID 65355631
4-amino-1-methyl-N-(1,1,1-trifluoropropan-2-yl)pyrazole-5-carboxamide
CID 70115891
4-amino-N-(2,3-dimethylbutyl)-1-methylpyrazole-5-carboxamide
CID 65359284
4-amino-N-(1-methoxypentan-2-yl)-1-methylpyrazole-5-carboxamide
CID 65359812
4-amino-N-(3-hydroxy-2-methylpropyl)-1-methylpyrazole-5-carboxamide
CID 65359621
4-amino-N-butan-2-yl-N,1-dimethylpyrazole-5-carboxamide
CID 65355914
4-amino-N-[(1S)-2-hydroxy-1-phenylethyl]-1-methylpyrazole-5-carboxamide
CID 107861729
5-amino-2-chloro-N-[4-(dimethylamino)butan-2-yl]pyridine-4-carboxamide
CID 114089452

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide (CID 65359893) is 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide is CC(CCN(C)C)NC(=O)c1c(N)cnn1C.
What is the InChIKey of 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide?
The InChIKey is WMSACZMBMZMKPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N5O/c1-8(5-6-15(2)3)14-11(17)10-9(12)7-13-16(10)4/h7-8H,5-6,12H2,1-4H3,(H,14,17).
What are the key properties of 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide?
4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide has a molecular weight of 239.32 g/mol, XLogP of 0.07, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[4-(dimethylamino)butan-2-yl]-1-methylpyrazole-5-carboxamide is sourced from PubChem (CID 65359893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).