4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide

C10H18N4O — CID 65358594

IUPAC4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)N(C)C(C)C)n1
InChIInChI=1S/C10H18N4O/c1-5-14-6-8(11)9(12-14)10(15)13(4)7(2)3/h6-7H,5,11H2,1-4H3
InChIKeyAKUZMAOHBFWMHY-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.97
Rot. Bonds3

About 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide

4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide (PubChem CID 65358594) has the molecular formula C10H18N4O and a molecular weight of 210.28 g/mol. Its IUPAC name is 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide
PubChem CID65358594
Molecular FormulaC10H18N4O
Molecular Weight210.28 g/mol
Exact Mass210.15
IUPAC Name4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide
SMILESCCn1cc(N)c(C(=O)N(C)C(C)C)n1
InChIInChI=1S/C10H18N4O/c1-5-14-6-8(11)9(12-14)10(15)13(4)7(2)3/h6-7H,5,11H2,1-4H3
InChIKeyAKUZMAOHBFWMHY-UHFFFAOYSA-N
XLogP0.97
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-N,1-diethyl-N-(2-methylbutyl)pyrazole-3-carboxamide
CID 79476986
4-amino-1-ethyl-N-(2-hydroxyethyl)-N-methylpyrazole-3-carboxamide
CID 65359090
4-amino-N,1-diethyl-N-(2,2,2-trifluoroethyl)pyrazole-3-carboxamide
CID 65358307
4-amino-1-ethyl-N-(2-hydroxy-3-methoxypropyl)-N-methylpyrazole-3-carboxamide
CID 65358116
4-amino-1-ethyl-N-[2-[ethyl(methyl)amino]ethyl]pyrazole-3-carboxamide
CID 65357738
4-amino-1-ethyl-N-(2-hydroxyethyl)-N-propylpyrazole-3-carboxamide
CID 65358051
ethyl 2-[(4-amino-1-ethylpyrazole-3-carbonyl)-(2-methylpropyl)amino]acetate
CID 65358337
4-amino-N-[2-(tert-butylamino)-2-oxoethyl]-1-ethyl-N-methylpyrazole-3-carboxamide
CID 65357964
ethyl 3-[(4-amino-1-ethylpyrazole-3-carbonyl)-methylamino]propanoate
CID 65358214
4-amino-1-ethyl-N-propan-2-yl-N-(pyridin-3-ylmethyl)pyrazole-3-carboxamide
CID 65357815
4-amino-1-ethyl-N-(2,2,3-trimethylbutyl)pyrazole-3-carboxamide
CID 114098963
4-amino-1-ethyl-N-[(1-hydroxycyclopentyl)methyl]-N-methylpyrazole-3-carboxamide
CID 114946837

Frequently Asked Questions

What is the IUPAC name of 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide?
The IUPAC name of 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide (CID 65358594) is 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide.
What is the SMILES notation for 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide?
The canonical SMILES for 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide is CCn1cc(N)c(C(=O)N(C)C(C)C)n1.
What is the InChIKey of 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide?
The InChIKey is AKUZMAOHBFWMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4O/c1-5-14-6-8(11)9(12-14)10(15)13(4)7(2)3/h6-7H,5,11H2,1-4H3.
What are the key properties of 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide?
4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-ethyl-N-methyl-N-propan-2-ylpyrazole-3-carboxamide is sourced from PubChem (CID 65358594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).