4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine

C23H37NO — CID 170869380

IUPAC4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine
SMILESCCc1cc2c(cc1CCCN1CCOCC1)C(C)(C)CCC2(C)C
InChIInChI=1S/C23H37NO/c1-6-18-16-20-21(23(4,5)10-9-22(20,2)3)17-19(18)8-7-11-24-12-14-25-15-13-24/h16-17H,6-15H2,1-5H3
InChIKeyCOXNIBHRBBSYRZ-UHFFFAOYSA-N
MW343.56 g/mol
LogP4.86
Rot. Bonds5

About 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine

4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine (PubChem CID 170869380) has the molecular formula C23H37NO and a molecular weight of 343.56 g/mol. Its IUPAC name is 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine.

Molecular Properties

Compound Name4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine
PubChem CID170869380
Molecular FormulaC23H37NO
Molecular Weight343.56 g/mol
Exact Mass343.29
IUPAC Name4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine
SMILESCCc1cc2c(cc1CCCN1CCOCC1)C(C)(C)CCC2(C)C
InChIInChI=1S/C23H37NO/c1-6-18-16-20-21(23(4,5)10-9-22(20,2)3)17-19(18)8-7-11-24-12-14-25-15-13-24/h16-17H,6-15H2,1-5H3
InChIKeyCOXNIBHRBBSYRZ-UHFFFAOYSA-N
XLogP4.86
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.56
LogP ≤ 54.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[3-[3-(3-morpholin-4-ylpropyl)naphthalen-2-yl]propyl]morpholine
CID 170869299
4-[3-[3,5-bis(3-morpholin-4-ylpropyl)phenyl]propyl]morpholine
CID 170870147
N-(3-morpholin-4-ylpropyl)-5-[(3,5,5,8,8-pentamethyl-6,7-dihydronaphthalen-2-yl)methyl]furan-2-carboxamide
CID 21047764
3-fluoro-4-(3-morpholin-4-ylpropyl)phenol
CID 170869738
4-[3-(12-tricyclo[9.2.2.14,8]hexadeca-1(13),4(16),5,7,11,14-hexaenyl)propyl]morpholine
CID 170869416
4-[3-(4-bromo-2-methylphenyl)propyl]morpholine
CID 170870052
N,N-dimethyl-2-(3-morpholin-4-ylpropyl)-4-nitroaniline
CID 170869990
N,N-diethyl-3-methyl-4-(3-morpholin-4-ylpropyl)aniline
CID 170870635
1-[5-(3-morpholin-4-ylpropyl)furan-2-yl]ethanone
CID 162740835
6-ethoxy-3-(3-morpholin-4-ylpropyl)-1H-quinolin-2-one
CID 170870835
6-(bromomethyl)-7-hexyl-1,1,4,4-tetramethyl-2,3-dihydronaphthalene
CID 22456869
4-[3-(2-ethoxy-4-morpholin-4-ylphenyl)propyl]morpholine
CID 170870634

Frequently Asked Questions

What is the IUPAC name of 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine?
The IUPAC name of 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine (CID 170869380) is 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine.
What is the SMILES notation for 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine?
The canonical SMILES for 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine is CCc1cc2c(cc1CCCN1CCOCC1)C(C)(C)CCC2(C)C.
What is the InChIKey of 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine?
The InChIKey is COXNIBHRBBSYRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37NO/c1-6-18-16-20-21(23(4,5)10-9-22(20,2)3)17-19(18)8-7-11-24-12-14-25-15-13-24/h16-17H,6-15H2,1-5H3.
What are the key properties of 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine?
4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine has a molecular weight of 343.56 g/mol, XLogP of 4.86, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(3-ethyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)propyl]morpholine is sourced from PubChem (CID 170869380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).