HVNMUYMCJNHSLC-UHFFFAOYSA-N

Name: HVNMUYMCJNHSLC-UHFFFAOYSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₅H₂₁N₃O₃ — CID 59326995

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

IUPAC[4-[[3-(3,6-dihydro-2H-pyran-4-yl)-2-pyridinyl]oxy]phenyl]-(1-methylbenzimidazol-2-yl)methanone

SMILESCn1c(C(=O)c2ccc(Oc3ncccc3C3=CCOCC3)cc2)nc2ccccc21

InChIInChI=1S/C25H21N3O3/c1-28-22-7-3-2-6-21(22)27-24(28)23(29)18-8-10-19(11-9-18)31-25-20(5-4-14-26-25)17-12-15-30-16-13-17/h2-12,14H,13,15-16H2,1H3

InChIKeyHVNMUYMCJNHSLC-UHFFFAOYSA-N

MW411.46 g/mol

LogP4.80

Rot. Bonds5

About HVNMUYMCJNHSLC-UHFFFAOYSA-N

HVNMUYMCJNHSLC-UHFFFAOYSA-N (PubChem CID 59326995) has the molecular formula C₂₅H₂₁N₃O₃ and a molecular weight of 411.46 g/mol. Its IUPAC name is [4-[[3-(3,6-dihydro-2H-pyran-4-yl)-2-pyridinyl]oxy]phenyl]-(1-methylbenzimidazol-2-yl)methanone.

Molecular Properties

Compound Name	HVNMUYMCJNHSLC-UHFFFAOYSA-N
PubChem CID	59326995
Molecular Formula	C₂₅H₂₁N₃O₃
Molecular Weight	411.46 g/mol
Exact Mass	411.16
IUPAC Name	[4-[[3-(3,6-dihydro-2H-pyran-4-yl)-2-pyridinyl]oxy]phenyl]-(1-methylbenzimidazol-2-yl)methanone
SMILES	Cn1c(C(=O)c2ccc(Oc3ncccc3C3=CCOCC3)cc2)nc2ccccc21
InChI	InChI=1S/C25H21N3O3/c1-28-22-7-3-2-6-21(22)27-24(28)23(29)18-8-10-19(11-9-18)31-25-20(5-4-14-26-25)17-12-15-30-16-13-17/h2-12,14H,13,15-16H2,1H3
InChIKey	HVNMUYMCJNHSLC-UHFFFAOYSA-N
XLogP	4.80
TPSA	66.24 Å²
H-Bond Donors
H-Bond Acceptors	6
Rotatable Bonds	5
Heavy Atoms	31
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	411.46
LogP ≤ 5	4.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of HVNMUYMCJNHSLC-UHFFFAOYSA-N?

The IUPAC name of HVNMUYMCJNHSLC-UHFFFAOYSA-N (CID 59326995) is [4-[[3-(3,6-dihydro-2H-pyran-4-yl)-2-pyridinyl]oxy]phenyl]-(1-methylbenzimidazol-2-yl)methanone.

What is the SMILES notation for HVNMUYMCJNHSLC-UHFFFAOYSA-N?

The canonical SMILES for HVNMUYMCJNHSLC-UHFFFAOYSA-N is Cn1c(C(=O)c2ccc(Oc3ncccc3C3=CCOCC3)cc2)nc2ccccc21.

What is the InChIKey of HVNMUYMCJNHSLC-UHFFFAOYSA-N?

The InChIKey is HVNMUYMCJNHSLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N3O3/c1-28-22-7-3-2-6-21(22)27-24(28)23(29)18-8-10-19(11-9-18)31-25-20(5-4-14-26-25)17-12-15-30-16-13-17/h2-12,14H,13,15-16H2,1H3.

What are the key properties of HVNMUYMCJNHSLC-UHFFFAOYSA-N?

HVNMUYMCJNHSLC-UHFFFAOYSA-N has a molecular weight of 411.46 g/mol, XLogP of 4.80, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for HVNMUYMCJNHSLC-UHFFFAOYSA-N is sourced from PubChem (CID 59326995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 59326995 — identifiers, structure, computed properties (public domain)

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