N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide

C18H21N3O4 — CID 119052734

IUPACN-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cccnc2OC(C)C)c(C(N)=O)c1
InChIInChI=1S/C18H21N3O4/c1-4-24-12-7-8-15(14(10-12)16(19)22)21-17(23)13-6-5-9-20-18(13)25-11(2)3/h5-11H,4H2,1-3H3,(H2,19,22)(H,21,23)
InChIKeyCGSUQSGPFGQDRF-UHFFFAOYSA-N
MW343.38 g/mol
LogP2.62
Rot. Bonds7

About N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide

N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide (PubChem CID 119052734) has the molecular formula C18H21N3O4 and a molecular weight of 343.38 g/mol. Its IUPAC name is N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide
PubChem CID119052734
Molecular FormulaC18H21N3O4
Molecular Weight343.38 g/mol
Exact Mass343.15
IUPAC NameN-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide
SMILESCCOc1ccc(NC(=O)c2cccnc2OC(C)C)c(C(N)=O)c1
InChIInChI=1S/C18H21N3O4/c1-4-24-12-7-8-15(14(10-12)16(19)22)21-17(23)13-6-5-9-20-18(13)25-11(2)3/h5-11H,4H2,1-3H3,(H2,19,22)(H,21,23)
InChIKeyCGSUQSGPFGQDRF-UHFFFAOYSA-N
XLogP2.62
TPSA103.54 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2,4-dimethoxyphenyl)-2-ethoxypyridine-3-carboxamide
CID 2110255
N-[2-[(2R)-butan-2-yl]phenyl]-2-ethoxypyridine-3-carboxamide
CID 7936129
2-ethoxy-N-(2-fluorophenyl)pyridine-3-carboxamide
CID 2096181
2-bromo-N-(2-methyl-4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 103754715
2-ethoxy-N-pyridin-3-ylpyridine-3-carboxamide
CID 23876862
2,3-difluoro-N-(2-propan-2-yloxy-3-pyridinyl)benzamide
CID 62661805
2-ethoxy-N-(2-phenylphenyl)pyridine-3-carboxamide
CID 2464326
N-(3-acetylphenyl)-2-ethoxypyridine-3-carboxamide
CID 7959021
N-(2-anilinophenyl)-2-ethoxypyridine-3-carboxamide
CID 44760849
2-ethoxy-N-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
CID 7962641
propan-2-yl 2-propan-2-yloxypyridine-3-carboxylate
CID 121229095
N-(4-bromo-2-carbamothioylphenyl)-2-methoxypyridine-3-carboxamide
CID 82695069

Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide?
The IUPAC name of N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide (CID 119052734) is N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide.
What is the SMILES notation for N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide?
The canonical SMILES for N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide is CCOc1ccc(NC(=O)c2cccnc2OC(C)C)c(C(N)=O)c1.
What is the InChIKey of N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide?
The InChIKey is CGSUQSGPFGQDRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O4/c1-4-24-12-7-8-15(14(10-12)16(19)22)21-17(23)13-6-5-9-20-18(13)25-11(2)3/h5-11H,4H2,1-3H3,(H2,19,22)(H,21,23).
What are the key properties of N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide?
N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide has a molecular weight of 343.38 g/mol, XLogP of 2.62, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoyl-4-ethoxyphenyl)-2-propan-2-yloxypyridine-3-carboxamide is sourced from PubChem (CID 119052734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).