5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide

C15H20N4O2 — CID 144571675

IUPAC5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide
SMILESCCCOc1ccc(-c2nn(C)c(N)c2C(=O)NC)cc1
InChIInChI=1S/C15H20N4O2/c1-4-9-21-11-7-5-10(6-8-11)13-12(15(20)17-2)14(16)19(3)18-13/h5-8H,4,9,16H2,1-3H3,(H,17,20)
InChIKeyRWFCKLZXHJGQBB-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.82
Rot. Bonds5

About 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide

5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide (PubChem CID 144571675) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide
PubChem CID144571675
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide
SMILESCCCOc1ccc(-c2nn(C)c(N)c2C(=O)NC)cc1
InChIInChI=1S/C15H20N4O2/c1-4-9-21-11-7-5-10(6-8-11)13-12(15(20)17-2)14(16)19(3)18-13/h5-8H,4,9,16H2,1-3H3,(H,17,20)
InChIKeyRWFCKLZXHJGQBB-UHFFFAOYSA-N
XLogP1.82
TPSA82.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N,4-dimethyl-6-(4-propoxyphenyl)pyrimidine-5-carboxamide
CID 54853581
3-amino-N-methyl-5-(4-propoxyphenyl)-1H-pyrazole-4-carboxamide
CID 144571706
3-(4-butoxyphenyl)-1,4-dimethylpyrazol-5-amine
CID 43336628
1-ethyl-3-(4-propoxyphenyl)pyrazol-4-amine
CID 83216682
2-amino-N-ethyl-6-(4-propoxyphenyl)pyrimidine-4-carboxamide
CID 54853940
2-amino-N,4-dimethyl-6-[4-(2-phenylethoxy)phenyl]pyrimidine-5-carboxamide
CID 54853951
4-amino-1-methyl-N-(4-propoxyphenyl)pyrazole-3-carboxamide
CID 65353904
3-butyl-2-methyl-5-(4-propoxyphenyl)imidazol-4-amine
CID 62495773
N-(methylcarbamothioyl)-4-propoxybenzamide
CID 3665751
4-(4-propoxyphenyl)benzamide
CID 23771495
4-acetyl-2-methyl-6-(4-propoxyphenyl)pyridazin-3-one
CID 82444386
ethyl 2-amino-4-[4-(2-methoxyethoxy)phenyl]-6-methylpyrimidine-5-carboxylate
CID 54851650

Frequently Asked Questions

What is the IUPAC name of 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide?
The IUPAC name of 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide (CID 144571675) is 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide.
What is the SMILES notation for 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide?
The canonical SMILES for 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide is CCCOc1ccc(-c2nn(C)c(N)c2C(=O)NC)cc1.
What is the InChIKey of 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide?
The InChIKey is RWFCKLZXHJGQBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-4-9-21-11-7-5-10(6-8-11)13-12(15(20)17-2)14(16)19(3)18-13/h5-8H,4,9,16H2,1-3H3,(H,17,20).
What are the key properties of 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide?
5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N,1-dimethyl-3-(4-propoxyphenyl)pyrazole-4-carboxamide is sourced from PubChem (CID 144571675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).