(R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol

C20H21FN4O2 — CID 139300276

IUPAC(R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol
SMILESCc1ccn(-c2cc(N3CCOCC3)cc([C@H](O)c3ccc(F)cc3)n2)n1
InChIInChI=1S/C20H21FN4O2/c1-14-6-7-25(23-14)19-13-17(24-8-10-27-11-9-24)12-18(22-19)20(26)15-2-4-16(21)5-3-15/h2-7,12-13,20,26H,8-11H2,1H3/t20-/m1/s1
InChIKeyKWBPFYOWXWDPFD-HXUWFJFHSA-N
MW368.41 g/mol
LogP2.63
Rot. Bonds4

About (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol

(R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol (PubChem CID 139300276) has the molecular formula C20H21FN4O2 and a molecular weight of 368.41 g/mol. Its IUPAC name is (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol.

Molecular Properties

Compound Name(R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol
PubChem CID139300276
Molecular FormulaC20H21FN4O2
Molecular Weight368.41 g/mol
Exact Mass368.16
IUPAC Name(R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol
SMILESCc1ccn(-c2cc(N3CCOCC3)cc([C@H](O)c3ccc(F)cc3)n2)n1
InChIInChI=1S/C20H21FN4O2/c1-14-6-7-25(23-14)19-13-17(24-8-10-27-11-9-24)12-18(22-19)20(26)15-2-4-16(21)5-3-15/h2-7,12-13,20,26H,8-11H2,1H3/t20-/m1/s1
InChIKeyKWBPFYOWXWDPFD-HXUWFJFHSA-N
XLogP2.63
TPSA63.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.41
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol?
The IUPAC name of (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol (CID 139300276) is (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol.
What is the SMILES notation for (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol?
The canonical SMILES for (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol is Cc1ccn(-c2cc(N3CCOCC3)cc([C@H](O)c3ccc(F)cc3)n2)n1.
What is the InChIKey of (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol?
The InChIKey is KWBPFYOWXWDPFD-HXUWFJFHSA-N. The full InChI is InChI=1S/C20H21FN4O2/c1-14-6-7-25(23-14)19-13-17(24-8-10-27-11-9-24)12-18(22-19)20(26)15-2-4-16(21)5-3-15/h2-7,12-13,20,26H,8-11H2,1H3/t20-/m1/s1.
What are the key properties of (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol?
(R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol has a molecular weight of 368.41 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(4-fluorophenyl)-[6-(3-methylpyrazol-1-yl)-4-morpholin-4-yl-2-pyridinyl]methanol is sourced from PubChem (CID 139300276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).