6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide

C19H25N3O2 — CID 109151959

IUPAC6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCCC(C)Nc1ccc(C(=O)NCCc2ccccc2OC)cn1
InChIInChI=1S/C19H25N3O2/c1-4-14(2)22-18-10-9-16(13-21-18)19(23)20-12-11-15-7-5-6-8-17(15)24-3/h5-10,13-14H,4,11-12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyAQDBZVJEJUAHDM-UHFFFAOYSA-N
MW327.43 g/mol
LogP3.27
Rot. Bonds8

About 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide

6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide (PubChem CID 109151959) has the molecular formula C19H25N3O2 and a molecular weight of 327.43 g/mol. Its IUPAC name is 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide
PubChem CID109151959
Molecular FormulaC19H25N3O2
Molecular Weight327.43 g/mol
Exact Mass327.19
IUPAC Name6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide
SMILESCCC(C)Nc1ccc(C(=O)NCCc2ccccc2OC)cn1
InChIInChI=1S/C19H25N3O2/c1-4-14(2)22-18-10-9-16(13-21-18)19(23)20-12-11-15-7-5-6-8-17(15)24-3/h5-10,13-14H,4,11-12H2,1-3H3,(H,20,23)(H,21,22)
InChIKeyAQDBZVJEJUAHDM-UHFFFAOYSA-N
XLogP3.27
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2-methoxyphenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
CID 107261353
N-[2-(2-methoxyphenyl)ethyl]-6-(4-methylanilino)pyridine-3-carboxamide
CID 109158821
6-[(2-methoxyphenyl)methylamino]-N-propylpyridine-3-carboxamide
CID 109151240
6-[2-(2-fluorophenyl)ethylamino]-N-[(2-methoxyphenyl)methyl]pyridine-3-carboxamide
CID 109157138
N-[2-(2-methoxyphenyl)ethyl]-5-(propan-2-ylamino)pyridine-2-carboxamide
CID 109179678
2-(diethylamino)-N-[2-(2-methoxyphenyl)ethyl]pyrimidine-5-carboxamide
CID 109260197
N-[2-(2-methoxyphenyl)ethyl]-4-methylbenzamide
CID 8911194
6-(butan-2-ylamino)-N-(3,4,5-trimethoxyphenyl)pyridine-3-carboxamide
CID 109152022
3,4-diethoxy-N-[2-(2-methoxyphenyl)ethyl]benzamide
CID 31115214
N-(2-phenylethyl)-6-(propan-2-ylamino)pyridine-3-carboxamide
CID 44764076
N'-butan-2-yl-N-[2-(2-methoxyphenyl)ethyl]oxamide
CID 108983990
N-(4-ethylphenyl)-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109158771

Frequently Asked Questions

What is the IUPAC name of 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The IUPAC name of 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide (CID 109151959) is 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide is CCC(C)Nc1ccc(C(=O)NCCc2ccccc2OC)cn1.
What is the InChIKey of 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide?
The InChIKey is AQDBZVJEJUAHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3O2/c1-4-14(2)22-18-10-9-16(13-21-18)19(23)20-12-11-15-7-5-6-8-17(15)24-3/h5-10,13-14H,4,11-12H2,1-3H3,(H,20,23)(H,21,22).
What are the key properties of 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide?
6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide has a molecular weight of 327.43 g/mol, XLogP of 3.27, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(butan-2-ylamino)-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide is sourced from PubChem (CID 109151959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).