BOOMYPYTFNGPNE-VXGBXAGGSA-N

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

C₁₉H₂₃N₇ — CID 90466128

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

IUPAC6-[4,6-bis[[(1R)-1-cyclopropylethyl]amino]-1,3,5-triazin-2-yl]pyridine-2-carbonitrile

SMILESC[C@@H](Nc1nc(N[C@H](C)C2CC2)nc(-c2cccc(C#N)n2)n1)C1CC1

InChIInChI=1S/C19H23N7/c1-11(13-6-7-13)21-18-24-17(16-5-3-4-15(10-20)23-16)25-19(26-18)22-12(2)14-8-9-14/h3-5,11-14H,6-9H2,1-2H3,(H2,21,22,24,25,26)/t11-,12-/m1/s1

InChIKeyBOOMYPYTFNGPNE-VXGBXAGGSA-N

MW349.44 g/mol

LogP3.23

Rot. Bonds7

About BOOMYPYTFNGPNE-VXGBXAGGSA-N

BOOMYPYTFNGPNE-VXGBXAGGSA-N (PubChem CID 90466128) has the molecular formula C₁₉H₂₃N₇ and a molecular weight of 349.44 g/mol. Its IUPAC name is 6-[4,6-bis[[(1R)-1-cyclopropylethyl]amino]-1,3,5-triazin-2-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name	BOOMYPYTFNGPNE-VXGBXAGGSA-N
PubChem CID	90466128
Molecular Formula	C₁₉H₂₃N₇
Molecular Weight	349.44 g/mol
Exact Mass	349.20
IUPAC Name	6-[4,6-bis[[(1R)-1-cyclopropylethyl]amino]-1,3,5-triazin-2-yl]pyridine-2-carbonitrile
SMILES	C[C@@H](Nc1nc(N[C@H](C)C2CC2)nc(-c2cccc(C#N)n2)n1)C1CC1
InChI	InChI=1S/C19H23N7/c1-11(13-6-7-13)21-18-24-17(16-5-3-4-15(10-20)23-16)25-19(26-18)22-12(2)14-8-9-14/h3-5,11-14H,6-9H2,1-2H3,(H2,21,22,24,25,26)/t11-,12-/m1/s1
InChIKey	BOOMYPYTFNGPNE-VXGBXAGGSA-N
XLogP	3.23
TPSA	99.41 Å²
H-Bond Donors	2
H-Bond Acceptors	7
Rotatable Bonds	7
Heavy Atoms	26
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	349.44
LogP ≤ 5	3.23
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of BOOMYPYTFNGPNE-VXGBXAGGSA-N?

The IUPAC name of BOOMYPYTFNGPNE-VXGBXAGGSA-N (CID 90466128) is 6-[4,6-bis[[(1R)-1-cyclopropylethyl]amino]-1,3,5-triazin-2-yl]pyridine-2-carbonitrile.

What is the SMILES notation for BOOMYPYTFNGPNE-VXGBXAGGSA-N?

The canonical SMILES for BOOMYPYTFNGPNE-VXGBXAGGSA-N is C[C@@H](Nc1nc(N[C@H](C)C2CC2)nc(-c2cccc(C#N)n2)n1)C1CC1.

What is the InChIKey of BOOMYPYTFNGPNE-VXGBXAGGSA-N?

The InChIKey is BOOMYPYTFNGPNE-VXGBXAGGSA-N. The full InChI is InChI=1S/C19H23N7/c1-11(13-6-7-13)21-18-24-17(16-5-3-4-15(10-20)23-16)25-19(26-18)22-12(2)14-8-9-14/h3-5,11-14H,6-9H2,1-2H3,(H2,21,22,24,25,26)/t11-,12-/m1/s1.

What are the key properties of BOOMYPYTFNGPNE-VXGBXAGGSA-N?

BOOMYPYTFNGPNE-VXGBXAGGSA-N has a molecular weight of 349.44 g/mol, XLogP of 3.23, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for BOOMYPYTFNGPNE-VXGBXAGGSA-N is sourced from PubChem (CID 90466128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 90466128 — identifiers, structure, computed properties (public domain)

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