Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate

Name: Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₇H₁₉N₃O₃ — CID 139362692

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate

SMILESC=C(NC(=O)OCC)Nc1ncccc1OCc1ccccc1

InChIInChI=1S/C17H19N3O3/c1-3-22-17(21)20-13(2)19-16-15(10-7-11-18-16)23-12-14-8-5-4-6-9-14/h4-11H,2-3,12H2,1H3,(H,18,19)(H,20,21)

InChIKeyKHIVGXWRPLYYEL-UHFFFAOYSA-N

MW313.36 g/mol

LogP3.29

Rot. Bonds7

About Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate

Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate (PubChem CID 139362692) has the molecular formula C₁₇H₁₉N₃O₃ and a molecular weight of 313.36 g/mol. Its IUPAC name is ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate.

Molecular Properties

Compound Name	Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate
PubChem CID	139362692
Molecular Formula	C₁₇H₁₉N₃O₃
Molecular Weight	313.36 g/mol
Exact Mass	313.14
IUPAC Name	ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate
SMILES	C=C(NC(=O)OCC)Nc1ncccc1OCc1ccccc1
InChI	InChI=1S/C17H19N3O3/c1-3-22-17(21)20-13(2)19-16-15(10-7-11-18-16)23-12-14-8-5-4-6-9-14/h4-11H,2-3,12H2,1H3,(H,18,19)(H,20,21)
InChIKey	KHIVGXWRPLYYEL-UHFFFAOYSA-N
XLogP	3.29
TPSA	72.48 Å²
H-Bond Donors	2
H-Bond Acceptors	5
Rotatable Bonds	7
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	313.36
LogP ≤ 5	3.29
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate?

The IUPAC name of Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate (CID 139362692) is ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate.

What is the SMILES notation for Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate?

The canonical SMILES for Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate is C=C(NC(=O)OCC)Nc1ncccc1OCc1ccccc1.

What is the InChIKey of Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate?

The InChIKey is KHIVGXWRPLYYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O3/c1-3-22-17(21)20-13(2)19-16-15(10-7-11-18-16)23-12-14-8-5-4-6-9-14/h4-11H,2-3,12H2,1H3,(H,18,19)(H,20,21).

What are the key properties of Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate?

Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate has a molecular weight of 313.36 g/mol, XLogP of 3.29, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for Ethyl N-[1-[(3-phenylmethoxy-2-pyridinyl)amino]ethenyl]carbamate is sourced from PubChem (CID 139362692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 139362692 — identifiers, structure, computed properties (public domain)

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