UNLSTYDFJIXJDP-HSZRJFAPSA-N

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

C₂₅H₂₇F₃N₆O — CID 134325497

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

IUPACN-cyclopropyl-5-[1-[5-[[(4R)-3,3-difluoro-1-methylpiperidin-4-yl]amino]-3-pyridinyl]pyrazol-4-yl]-2-fluoro-4-methylbenzamide

SMILESCc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(N[C@@H]3CCN(C)CC3(F)F)c2)c1

InChIInChI=1S/C25H27F3N6O/c1-15-7-22(26)21(24(35)32-17-3-4-17)9-20(15)16-10-30-34(13-16)19-8-18(11-29-12-19)31-23-5-6-33(2)14-25(23,27)28/h7-13,17,23,31H,3-6,14H2,1-2H3,(H,32,35)/t23-/m1/s1

InChIKeyUNLSTYDFJIXJDP-HSZRJFAPSA-N

MW484.53 g/mol

LogP4.03

Rot. Bonds6

About UNLSTYDFJIXJDP-HSZRJFAPSA-N

UNLSTYDFJIXJDP-HSZRJFAPSA-N (PubChem CID 134325497) has the molecular formula C₂₅H₂₇F₃N₆O and a molecular weight of 484.53 g/mol. Its IUPAC name is N-cyclopropyl-5-[1-[5-[[(4R)-3,3-difluoro-1-methylpiperidin-4-yl]amino]-3-pyridinyl]pyrazol-4-yl]-2-fluoro-4-methylbenzamide.

Molecular Properties

Compound Name	UNLSTYDFJIXJDP-HSZRJFAPSA-N
PubChem CID	134325497
Molecular Formula	C₂₅H₂₇F₃N₆O
Molecular Weight	484.53 g/mol
Exact Mass	484.22
IUPAC Name	N-cyclopropyl-5-[1-[5-[[(4R)-3,3-difluoro-1-methylpiperidin-4-yl]amino]-3-pyridinyl]pyrazol-4-yl]-2-fluoro-4-methylbenzamide
SMILES	Cc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(N[C@@H]3CCN(C)CC3(F)F)c2)c1
InChI	InChI=1S/C25H27F3N6O/c1-15-7-22(26)21(24(35)32-17-3-4-17)9-20(15)16-10-30-34(13-16)19-8-18(11-29-12-19)31-23-5-6-33(2)14-25(23,27)28/h7-13,17,23,31H,3-6,14H2,1-2H3,(H,32,35)/t23-/m1/s1
InChIKey	UNLSTYDFJIXJDP-HSZRJFAPSA-N
XLogP	4.03
TPSA	75.08 Å²
H-Bond Donors	2
H-Bond Acceptors	6
Rotatable Bonds	6
Heavy Atoms	35
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	484.53
LogP ≤ 5	4.03
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of UNLSTYDFJIXJDP-HSZRJFAPSA-N?

The IUPAC name of UNLSTYDFJIXJDP-HSZRJFAPSA-N (CID 134325497) is N-cyclopropyl-5-[1-[5-[[(4R)-3,3-difluoro-1-methylpiperidin-4-yl]amino]-3-pyridinyl]pyrazol-4-yl]-2-fluoro-4-methylbenzamide.

What is the SMILES notation for UNLSTYDFJIXJDP-HSZRJFAPSA-N?

The canonical SMILES for UNLSTYDFJIXJDP-HSZRJFAPSA-N is Cc1cc(F)c(C(=O)NC2CC2)cc1-c1cnn(-c2cncc(N[C@@H]3CCN(C)CC3(F)F)c2)c1.

What is the InChIKey of UNLSTYDFJIXJDP-HSZRJFAPSA-N?

The InChIKey is UNLSTYDFJIXJDP-HSZRJFAPSA-N. The full InChI is InChI=1S/C25H27F3N6O/c1-15-7-22(26)21(24(35)32-17-3-4-17)9-20(15)16-10-30-34(13-16)19-8-18(11-29-12-19)31-23-5-6-33(2)14-25(23,27)28/h7-13,17,23,31H,3-6,14H2,1-2H3,(H,32,35)/t23-/m1/s1.

What are the key properties of UNLSTYDFJIXJDP-HSZRJFAPSA-N?

UNLSTYDFJIXJDP-HSZRJFAPSA-N has a molecular weight of 484.53 g/mol, XLogP of 4.03, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for UNLSTYDFJIXJDP-HSZRJFAPSA-N is sourced from PubChem (CID 134325497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 134325497 — identifiers, structure, computed properties (public domain)

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