N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide

Name: N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₈H₂₂N₂O₂S — CID 46991816

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

IUPACN-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide

SMILESO=C(CCc1cccnc1)N(Cc1ccsc1)CC1CCCO1

InChIInChI=1S/C18H22N2O2S/c21-18(6-5-15-3-1-8-19-11-15)20(12-16-7-10-23-14-16)13-17-4-2-9-22-17/h1,3,7-8,10-11,14,17H,2,4-6,9,12-13H2

InChIKeyDQYMWRIXJKTEIB-UHFFFAOYSA-N

MW330.45 g/mol

LogP3.28

Rot. Bonds7

About N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide

N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide (PubChem CID 46991816) has the molecular formula C₁₈H₂₂N₂O₂S and a molecular weight of 330.45 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide.

Molecular Properties

Compound Name	N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide
PubChem CID	46991816
Molecular Formula	C₁₈H₂₂N₂O₂S
Molecular Weight	330.45 g/mol
Exact Mass	330.14
IUPAC Name	N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide
SMILES	O=C(CCc1cccnc1)N(Cc1ccsc1)CC1CCCO1
InChI	InChI=1S/C18H22N2O2S/c21-18(6-5-15-3-1-8-19-11-15)20(12-16-7-10-23-14-16)13-17-4-2-9-22-17/h1,3,7-8,10-11,14,17H,2,4-6,9,12-13H2
InChIKey	DQYMWRIXJKTEIB-UHFFFAOYSA-N
XLogP	3.28
TPSA	42.43 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	7
Heavy Atoms	23
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	330.45
LogP ≤ 5	3.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide?

The IUPAC name of N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide (CID 46991816) is N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide.

What is the SMILES notation for N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide?

The canonical SMILES for N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide is O=C(CCc1cccnc1)N(Cc1ccsc1)CC1CCCO1.

What is the InChIKey of N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide?

The InChIKey is DQYMWRIXJKTEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2S/c21-18(6-5-15-3-1-8-19-11-15)20(12-16-7-10-23-14-16)13-17-4-2-9-22-17/h1,3,7-8,10-11,14,17H,2,4-6,9,12-13H2.

What are the key properties of N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide?

N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide has a molecular weight of 330.45 g/mol, XLogP of 3.28, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-(oxolan-2-ylmethyl)-3-pyridin-3-yl-N-(thiophen-3-ylmethyl)propanamide is sourced from PubChem (CID 46991816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 46991816 — identifiers, structure, computed properties (public domain)

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