6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide

C23H20N4O2 — CID 172656290

IUPAC6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide
SMILESCOc1ncc(-c2ccc3cc(C(=O)NCCc4cccnc4)ccc3c2)cn1
InChIInChI=1S/C23H20N4O2/c1-29-23-26-14-21(15-27-23)19-5-4-18-12-20(7-6-17(18)11-19)22(28)25-10-8-16-3-2-9-24-13-16/h2-7,9,11-15H,8,10H2,1H3,(H,25,28)
InChIKeyPLAKSZZXAHXKSG-UHFFFAOYSA-N
MW384.44 g/mol
LogP3.67
Rot. Bonds6

About 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide

6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide (PubChem CID 172656290) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide.

Molecular Properties

Compound Name6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide
PubChem CID172656290
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide
SMILESCOc1ncc(-c2ccc3cc(C(=O)NCCc4cccnc4)ccc3c2)cn1
InChIInChI=1S/C23H20N4O2/c1-29-23-26-14-21(15-27-23)19-5-4-18-12-20(7-6-17(18)11-19)22(28)25-10-8-16-3-2-9-24-13-16/h2-7,9,11-15H,8,10H2,1H3,(H,25,28)
InChIKeyPLAKSZZXAHXKSG-UHFFFAOYSA-N
XLogP3.67
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-amino-3-methoxy-N-(2-pyridin-3-ylethyl)benzamide
CID 104782485
4-[2-(4-methoxyphenoxy)pyrimidin-5-yl]-N-(2-phenylethyl)benzamide
CID 53116686
1-methyl-N-(2-pyridin-3-ylethyl)indole-6-carboxamide
CID 112530368
3-bromo-4-methoxy-N-(3-pyridin-3-ylpropyl)benzamide
CID 110607078
4-bromo-3-methyl-N-(2-pyridin-3-ylethyl)benzamide
CID 67386076
N-(2-pyridin-3-ylethyl)-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 24661254
2-bromo-N-(2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 103752224
4-(1-propan-2-ylimidazol-2-yl)-N-(2-pyridin-3-ylethyl)benzamide
CID 122564685
3-methyl-4-(methylamino)-N-(2-pyridin-3-ylethyl)benzamide
CID 63210322
4-amino-N-(2-pyridin-3-ylethyl)benzamide
CID 60895367
2-(aminomethyl)-N-(2-pyridin-3-ylethyl)pyridine-4-carboxamide
CID 112530316
3-(aminomethyl)-N-(2-pyridin-3-ylethyl)benzamide
CID 60895534

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide?
The IUPAC name of 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide (CID 172656290) is 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide.
What is the SMILES notation for 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide?
The canonical SMILES for 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide is COc1ncc(-c2ccc3cc(C(=O)NCCc4cccnc4)ccc3c2)cn1.
What is the InChIKey of 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide?
The InChIKey is PLAKSZZXAHXKSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c1-29-23-26-14-21(15-27-23)19-5-4-18-12-20(7-6-17(18)11-19)22(28)25-10-8-16-3-2-9-24-13-16/h2-7,9,11-15H,8,10H2,1H3,(H,25,28).
What are the key properties of 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide?
6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide has a molecular weight of 384.44 g/mol, XLogP of 3.67, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxypyrimidin-5-yl)-N-(2-pyridin-3-ylethyl)naphthalene-2-carboxamide is sourced from PubChem (CID 172656290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).