4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide

C10H18N4O — CID 20549829

IUPAC4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide
SMILESCC(C)c1nn(C)c(C(=O)N(C)C)c1N
InChIInChI=1S/C10H18N4O/c1-6(2)8-7(11)9(14(5)12-8)10(15)13(3)4/h6H,11H2,1-5H3
InChIKeyPKWXYHRMVIPPLP-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.83
Rot. Bonds2

About 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide

4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide (PubChem CID 20549829) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide
PubChem CID20549829
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide
SMILESCC(C)c1nn(C)c(C(=O)N(C)C)c1N
InChIInChI=1S/C10H18N4O/c1-6(2)8-7(11)9(14(5)12-8)10(15)13(3)4/h6H,11H2,1-5H3
InChIKeyPKWXYHRMVIPPLP-UHFFFAOYSA-N
XLogP0.83
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]ethyl]-1,1-dimethylurea
CID 83116434
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]-N,N-dimethylacetamide
CID 66018194
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)-methylamino]ethanol
CID 66019160
1-methyl-3-propan-2-ylpyrazole-4,5-diamine
CID 66018774
1-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)-methylamino]propan-2-ol
CID 66019786
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)-(2-hydroxyethyl)amino]ethanol
CID 66019367
4-amino-3-ethyl-N-(2-hydroxypropyl)-N,1-dimethylpyrazole-5-carboxamide
CID 66119069
2-[(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)amino]acetic acid
CID 66019776
1-methyl-4-nitro-3-propan-2-ylpyrazole-5-carboxamide
CID 45097304
4-amino-N,1,3-trimethyl-N-(2-methylbutyl)pyrazole-5-carboxamide
CID 66122221
5-(4-amino-1-methyl-3-propan-2-ylpyrazol-5-yl)oxypentan-1-ol
CID 114216560
4-amino-N-(1-methoxypropan-2-yl)-N,1,3-trimethylpyrazole-5-carboxamide
CID 66124373

Frequently Asked Questions

What is the IUPAC name of 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide?
The IUPAC name of 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide (CID 20549829) is 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide.
What is the SMILES notation for 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide?
The canonical SMILES for 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide is CC(C)c1nn(C)c(C(=O)N(C)C)c1N.
What is the InChIKey of 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide?
The InChIKey is PKWXYHRMVIPPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-6(2)8-7(11)9(14(5)12-8)10(15)13(3)4/h6H,11H2,1-5H3.
What are the key properties of 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide?
4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N,N,1-trimethyl-3-propan-2-ylpyrazole-5-carboxamide is sourced from PubChem (CID 20549829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).