1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine

C26H30N6O2 — CID 121335817

IUPAC1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine
SMILESCn1nc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)c2ccccc21
InChIInChI=1S/C26H30N6O2/c1-31-23-5-3-2-4-21(23)26(30-31)29-18-6-8-20(9-7-18)34-24-17-19(32-12-14-33-15-13-32)16-22-25(24)28-11-10-27-22/h2-5,10-11,16-18,20H,6-9,12-15H2,1H3,(H,29,30)
InChIKeyVNRAZKYIZZAQOG-UHFFFAOYSA-N
MW458.57 g/mol
LogP4.16
Rot. Bonds5

About 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine

1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine (PubChem CID 121335817) has the molecular formula C26H30N6O2 and a molecular weight of 458.57 g/mol. Its IUPAC name is 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine.

Molecular Properties

Compound Name1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine
PubChem CID121335817
Molecular FormulaC26H30N6O2
Molecular Weight458.57 g/mol
Exact Mass458.24
IUPAC Name1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine
SMILESCn1nc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)c2ccccc21
InChIInChI=1S/C26H30N6O2/c1-31-23-5-3-2-4-21(23)26(30-31)29-18-6-8-20(9-7-18)34-24-17-19(32-12-14-33-15-13-32)16-22-25(24)28-11-10-27-22/h2-5,10-11,16-18,20H,6-9,12-15H2,1H3,(H,29,30)
InChIKeyVNRAZKYIZZAQOG-UHFFFAOYSA-N
XLogP4.16
TPSA77.33 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500458.57
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine with MolForge

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Related Compounds

3-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridin-2-amine
CID 121335611
3-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridin-2-amine
CID 121335616
3,5-dimethyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridin-2-amine
CID 121335619
2-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]furo[3,2-d]pyrimidin-4-amine
CID 121335912
5-fluoro-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-4-amine
CID 121335808
3-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]-[1,2,4]triazolo[4,3-a]pyrazin-8-amine
CID 121335869
2-N,2-N-dimethyl-4-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidine-2,4-diamine
CID 121335685
5-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridin-3-amine
CID 121335923
5-ethyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrimidin-2-amine
CID 90454078
5-methoxy-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyrazin-2-amine
CID 90454133
2-[2-[[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]amino]-4-pyridinyl]propan-2-ol
CID 121335604
N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 86281319

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine?
The IUPAC name of 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine (CID 121335817) is 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine.
What is the SMILES notation for 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine?
The canonical SMILES for 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine is Cn1nc(NC2CCC(Oc3cc(N4CCOCC4)cc4nccnc34)CC2)c2ccccc21.
What is the InChIKey of 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine?
The InChIKey is VNRAZKYIZZAQOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H30N6O2/c1-31-23-5-3-2-4-21(23)26(30-31)29-18-6-8-20(9-7-18)34-24-17-19(32-12-14-33-15-13-32)16-22-25(24)28-11-10-27-22/h2-5,10-11,16-18,20H,6-9,12-15H2,1H3,(H,29,30).
What are the key properties of 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine?
1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine has a molecular weight of 458.57 g/mol, XLogP of 4.16, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-[4-(7-morpholin-4-ylquinoxalin-5-yl)oxycyclohexyl]indazol-3-amine is sourced from PubChem (CID 121335817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).