6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine

C24H28N6O2 — CID 163594104

IUPAC6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine
SMILESCc1nnc(-c2ccc3c(c2)-c2c(ncnc2NC2CCC(N4CCOCC4)CC2)C3)o1
InChIInChI=1S/C24H28N6O2/c1-15-28-29-24(32-15)17-3-2-16-13-21-22(20(16)12-17)23(26-14-25-21)27-18-4-6-19(7-5-18)30-8-10-31-11-9-30/h2-3,12,14,18-19H,4-11,13H2,1H3,(H,25,26,27)
InChIKeyJYCWPSDXUJUYIW-UHFFFAOYSA-N
MW432.53 g/mol
LogP3.46
Rot. Bonds4

About 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine

6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine (PubChem CID 163594104) has the molecular formula C24H28N6O2 and a molecular weight of 432.53 g/mol. Its IUPAC name is 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine
PubChem CID163594104
Molecular FormulaC24H28N6O2
Molecular Weight432.53 g/mol
Exact Mass432.23
IUPAC Name6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine
SMILESCc1nnc(-c2ccc3c(c2)-c2c(ncnc2NC2CCC(N4CCOCC4)CC2)C3)o1
InChIInChI=1S/C24H28N6O2/c1-15-28-29-24(32-15)17-3-2-16-13-21-22(20(16)12-17)23(26-14-25-21)27-18-4-6-19(7-5-18)30-8-10-31-11-9-30/h2-3,12,14,18-19H,4-11,13H2,1H3,(H,25,26,27)
InChIKeyJYCWPSDXUJUYIW-UHFFFAOYSA-N
XLogP3.46
TPSA89.20 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.53
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine with MolForge

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Related Compounds

6-[1-(1-methylsulfonylpiperidin-4-yl)pyrazol-4-yl]-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine
CID 163790909
12-(1-methylpyrazol-4-yl)-N-(4-morpholin-4-ylcyclohexyl)-4,6,11-triazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,5,9,11-hexaen-3-amine
CID 163645764
ethyl 4-[[4-(dimethylamino)cyclohexyl]amino]-9H-indeno[2,1-d]pyrimidine-6-carboxylate;ethyl 4-(4-methoxyanilino)-9H-indeno[2,1-d]pyrimidine-6-carboxylate;ethyl 4-[(4-morpholin-4-ylcyclohexyl)amino]-9H-indeno[2,1-d]pyrimidine-6-carboxylate;methyl 4-[(4-morpholin-4-ylcyclohexyl)amino]-9H-indeno[2,1-d]pyrimidine-7-carboxylate
CID 163419488
4-N,4-N-dimethyl-1-N-[6-(1-methylpyrazol-4-yl)-9H-indeno[2,1-d]pyrimidin-4-yl]cyclohexane-1,4-diamine
CID 163640585
6-(2-methyl-1H-imidazol-5-yl)-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 130446838
7-fluoro-6-methyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 121255066
3-[4-[(4-morpholin-4-ylcyclohexyl)amino]quinazolin-6-yl]cyclohex-3-en-1-one
CID 130236172
5-bromo-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 140800582
6-(methoxymethyl)-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 118475288
2-[4-[(4-morpholin-4-ylcyclohexyl)amino]quinazolin-6-yl]acetonitrile
CID 118475287
6-ethenyl-N-(4-morpholin-4-ylcyclohexyl)quinazolin-4-amine
CID 118475339
7-bromo-N-(4-morpholin-4-ylcyclohexyl)-9H-pyrimido[4,5-b]indol-4-amine;N-(4-morpholin-4-ylcyclohexyl)-7-pyridin-4-yl-9H-pyrimido[4,5-b]indol-4-amine
CID 163566539

Frequently Asked Questions

What is the IUPAC name of 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine?
The IUPAC name of 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine (CID 163594104) is 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine?
The canonical SMILES for 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine is Cc1nnc(-c2ccc3c(c2)-c2c(ncnc2NC2CCC(N4CCOCC4)CC2)C3)o1.
What is the InChIKey of 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine?
The InChIKey is JYCWPSDXUJUYIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N6O2/c1-15-28-29-24(32-15)17-3-2-16-13-21-22(20(16)12-17)23(26-14-25-21)27-18-4-6-19(7-5-18)30-8-10-31-11-9-30/h2-3,12,14,18-19H,4-11,13H2,1H3,(H,25,26,27).
What are the key properties of 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine?
6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine has a molecular weight of 432.53 g/mol, XLogP of 3.46, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methyl-1,3,4-oxadiazol-2-yl)-N-(4-morpholin-4-ylcyclohexyl)-9H-indeno[2,1-d]pyrimidin-4-amine is sourced from PubChem (CID 163594104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).