N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide

C20H23N7O3 — CID 155010090

IUPACN-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2[nH]ncc2NC(=O)c2cncc(OC)c2)cn1
InChIInChI=1S/C20H23N7O3/c1-4-27(5-2)17-7-6-14(10-22-17)24-20(29)18-16(12-23-26-18)25-19(28)13-8-15(30-3)11-21-9-13/h6-12H,4-5H2,1-3H3,(H,23,26)(H,24,29)(H,25,28)
InChIKeySJAWFKQXZRGIMA-UHFFFAOYSA-N
MW409.45 g/mol
LogP2.56
Rot. Bonds8

About N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide

N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide (PubChem CID 155010090) has the molecular formula C20H23N7O3 and a molecular weight of 409.45 g/mol. Its IUPAC name is N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide
PubChem CID155010090
Molecular FormulaC20H23N7O3
Molecular Weight409.45 g/mol
Exact Mass409.19
IUPAC NameN-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide
SMILESCCN(CC)c1ccc(NC(=O)c2[nH]ncc2NC(=O)c2cncc(OC)c2)cn1
InChIInChI=1S/C20H23N7O3/c1-4-27(5-2)17-7-6-14(10-22-17)24-20(29)18-16(12-23-26-18)25-19(28)13-8-15(30-3)11-21-9-13/h6-12H,4-5H2,1-3H3,(H,23,26)(H,24,29)(H,25,28)
InChIKeySJAWFKQXZRGIMA-UHFFFAOYSA-N
XLogP2.56
TPSA125.13 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.45
LogP ≤ 52.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-[6-(diethylamino)-3-pyridinyl]-1H-pyrazole-4-carboxamide
CID 60971845
N-[6-[benzyl(ethyl)amino]-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113012586
methyl 4-[[6-(diethylamino)pyridine-3-carbonyl]amino]benzoate
CID 48650816
N-[6-(diethylamino)-3-pyridinyl]-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 55784199
5-methyl-N-[5-[[6-(1-methylpiperidin-4-yl)oxy-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]pyridine-3-carboxamide
CID 154654304
N-[6-(diethylamino)-3-pyridinyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 113014574
5-N-(2-ethoxyphenyl)-3-N-(3-methoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108895
methyl 5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-2-methyl-4-propyl-1H-pyrrole-3-carboxylate
CID 55845047
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-3,5-dimethoxybenzamide
CID 113022970
6-(dipropylamino)-N-(4-methoxyphenyl)pyridine-3-carboxamide
CID 109161818
N-[6-(diethylamino)-3-pyridinyl]-3-oxo-4H-1,4-benzothiazine-6-carboxamide
CID 55784088
N-[6-(diethylamino)-3-pyridinyl]-5-(2,2-dimethylpropanoylamino)-3-methylthiophene-2-carboxamide
CID 55784186

Frequently Asked Questions

What is the IUPAC name of N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide?
The IUPAC name of N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide (CID 155010090) is N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide.
What is the SMILES notation for N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide?
The canonical SMILES for N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide is CCN(CC)c1ccc(NC(=O)c2[nH]ncc2NC(=O)c2cncc(OC)c2)cn1.
What is the InChIKey of N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide?
The InChIKey is SJAWFKQXZRGIMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N7O3/c1-4-27(5-2)17-7-6-14(10-22-17)24-20(29)18-16(12-23-26-18)25-19(28)13-8-15(30-3)11-21-9-13/h6-12H,4-5H2,1-3H3,(H,23,26)(H,24,29)(H,25,28).
What are the key properties of N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide?
N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide has a molecular weight of 409.45 g/mol, XLogP of 2.56, 8 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[[6-(diethylamino)-3-pyridinyl]carbamoyl]-1H-pyrazol-4-yl]-5-methoxypyridine-3-carboxamide is sourced from PubChem (CID 155010090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).