4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide

C15H17N3O2 — CID 106262005

IUPAC4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cc(N)ccn1
InChIInChI=1S/C15H17N3O2/c1-20-14-5-3-2-4-11(14)6-8-18-15(19)13-10-12(16)7-9-17-13/h2-5,7,9-10H,6,8H2,1H3,(H2,16,17)(H,18,19)
InChIKeyZEPDJPPQIKVCHH-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.64
Rot. Bonds5

About 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide

4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide (PubChem CID 106262005) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
PubChem CID106262005
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1cc(N)ccn1
InChIInChI=1S/C15H17N3O2/c1-20-14-5-3-2-4-11(14)6-8-18-15(19)13-10-12(16)7-9-17-13/h2-5,7,9-10H,6,8H2,1H3,(H2,16,17)(H,18,19)
InChIKeyZEPDJPPQIKVCHH-UHFFFAOYSA-N
XLogP1.64
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide (CID 106262005) is 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide is COc1ccccc1CCNC(=O)c1cc(N)ccn1.
What is the InChIKey of 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is ZEPDJPPQIKVCHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-20-14-5-3-2-4-11(14)6-8-18-15(19)13-10-12(16)7-9-17-13/h2-5,7,9-10H,6,8H2,1H3,(H2,16,17)(H,18,19).
What are the key properties of 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide?
4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 1.64, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(2-methoxyphenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 106262005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).