3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide

C24H26FN5O3 — CID 86281846

IUPAC3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide
SMILESO=C(NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1)c1ccncc1F
InChIInChI=1S/C24H26FN5O3/c25-20-15-26-6-5-19(20)24(31)29-16-1-3-18(4-2-16)33-22-14-17(30-9-11-32-12-10-30)13-21-23(22)28-8-7-27-21/h5-8,13-16,18H,1-4,9-12H2,(H,29,31)
InChIKeyGBSZEXQHVPNIQI-UHFFFAOYSA-N
MW451.50 g/mol
LogP3.12
Rot. Bonds5

About 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide

3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide (PubChem CID 86281846) has the molecular formula C24H26FN5O3 and a molecular weight of 451.50 g/mol. Its IUPAC name is 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide
PubChem CID86281846
Molecular FormulaC24H26FN5O3
Molecular Weight451.50 g/mol
Exact Mass451.20
IUPAC Name3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide
SMILESO=C(NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1)c1ccncc1F
InChIInChI=1S/C24H26FN5O3/c25-20-15-26-6-5-19(20)24(31)29-16-1-3-18(4-2-16)33-22-14-17(30-9-11-32-12-10-30)13-21-23(22)28-8-7-27-21/h5-8,13-16,18H,1-4,9-12H2,(H,29,31)
InChIKeyGBSZEXQHVPNIQI-UHFFFAOYSA-N
XLogP3.12
TPSA89.47 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500451.50
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide with MolForge

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Related Compounds

N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 86281319
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridazine-3-carboxamide
CID 86281578
5-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine
CID 121335808
5-ethyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 90443960
4-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-1,3-thiazole-2-carboxamide
CID 90443995
2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]-N-[(3S)-oxolan-3-yl]pyrimidine-5-carboxamide
CID 138546172
methyl 4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexane-1-carboxylate
CID 86282798
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-6-(trifluoromethyl)pyridin-3-amine
CID 121335931
N-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]methyl]acetamide
CID 121335573
5-fluoro-4-N-methyl-2-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidine-2,4-diamine
CID 121335706
5-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridin-3-amine
CID 121335923
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-2-(trifluoromethyl)pyrimidin-5-amine
CID 121335789

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide (CID 86281846) is 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide is O=C(NC1CCC(Oc2cc(N3CCOCC3)cc3nccnc23)CC1)c1ccncc1F.
What is the InChIKey of 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide?
The InChIKey is GBSZEXQHVPNIQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26FN5O3/c25-20-15-26-6-5-19(20)24(31)29-16-1-3-18(4-2-16)33-22-14-17(30-9-11-32-12-10-30)13-21-23(22)28-8-7-27-21/h5-8,13-16,18H,1-4,9-12H2,(H,29,31).
What are the key properties of 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide?
3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide has a molecular weight of 451.50 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-4-carboxamide is sourced from PubChem (CID 86281846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).