3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]

C18H20N4 — CID 58466910

IUPAC3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]
SMILESCCN1C=NC2(CCc3c(cccc3-c3cncnc3)C2)C1
InChIInChI=1S/C18H20N4/c1-2-22-11-18(21-13-22)7-6-17-14(8-18)4-3-5-16(17)15-9-19-12-20-10-15/h3-5,9-10,12-13H,2,6-8,11H2,1H3
InChIKeyOUJFADBTFSCBRJ-UHFFFAOYSA-N
MW292.39 g/mol
LogP2.73
Rot. Bonds2

About 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]

3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole] (PubChem CID 58466910) has the molecular formula C18H20N4 and a molecular weight of 292.39 g/mol. Its IUPAC name is 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole].

Molecular Properties

Compound Name3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]
PubChem CID58466910
Molecular FormulaC18H20N4
Molecular Weight292.39 g/mol
Exact Mass292.17
IUPAC Name3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]
SMILESCCN1C=NC2(CCc3c(cccc3-c3cncnc3)C2)C1
InChIInChI=1S/C18H20N4/c1-2-22-11-18(21-13-22)7-6-17-14(8-18)4-3-5-16(17)15-9-19-12-20-10-15/h3-5,9-10,12-13H,2,6-8,11H2,1H3
InChIKeyOUJFADBTFSCBRJ-UHFFFAOYSA-N
XLogP2.73
TPSA41.38 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.39
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-ethylspiro[4H-imidazole-5,6'-7,8-dihydro-5H-naphthalene]-1'-yl)acetamide
CID 70228765
3'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-imidazolidine]-2',4'-dione
CID 58466662
3-methyl-8'-pyrimidin-5-ylspiro[1,3-oxazolidine-4,3'-2,4-dihydro-1H-naphthalene]-2-imine
CID 58466567
8'-pyrimidin-5-ylspiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine
CID 58467250
N,5,5-trimethyl-8'-pyrimidin-5-ylspiro[1,3-oxazolidine-4,3'-2,4-dihydro-1H-naphthalene]-2-imine
CID 136657359
2',3'-dimethyl-8-thiophen-3-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]
CID 70228450
2',3'-dimethyl-4-pyrimidin-5-ylspiro[1,3-dihydroindene-2,5'-4H-imidazole];(3S)-3'-methyl-8-pyridin-3-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]-2'-amine;3'-methyl-5-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole];4-(5-methylspiro[3,4-dihydropyrrole-2,7'-6,8-dihydro-5H-naphthalene]-1'-yl)-1,3-thiazole
CID 158239620
[(2S)-2-amino-5-bromo-3,4-dihydro-1H-naphthalen-2-yl]methanol;(3S)-8-bromo-2'-methylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];(3S)-2'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole];1,1,1-trimethoxyethane
CID 159029419
(5R)-8'-(furan-2-yl)spiro[1,4-dihydroimidazole-5,3'-2,4-dihydro-1H-naphthalene]-2-amine;(3S)-5'-methyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,2'-3,4-dihydropyrrole]
CID 159540926
5-[(4S)-2-aminospiro[5H-1,3-oxazole-4,6'-7,8-dihydro-5H-naphthalene]-1'-yl]pyridine-3-carbonitrile
CID 70228414
3-(ethylaminomethyl)-5-pyrimidin-5-yl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 58466739
2'-methyl-8-(6-methylpyrazin-2-yl)spiro[2,4-dihydro-1H-naphthalene-3,4'-5H-1,3-oxazole]
CID 58466941

Frequently Asked Questions

What is the IUPAC name of 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]?
The IUPAC name of 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole] (CID 58466910) is 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole].
What is the SMILES notation for 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]?
The canonical SMILES for 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole] is CCN1C=NC2(CCc3c(cccc3-c3cncnc3)C2)C1.
What is the InChIKey of 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]?
The InChIKey is OUJFADBTFSCBRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4/c1-2-22-11-18(21-13-22)7-6-17-14(8-18)4-3-5-16(17)15-9-19-12-20-10-15/h3-5,9-10,12-13H,2,6-8,11H2,1H3.
What are the key properties of 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole]?
3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole] has a molecular weight of 292.39 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-ethyl-8-pyrimidin-5-ylspiro[2,4-dihydro-1H-naphthalene-3,5'-4H-imidazole] is sourced from PubChem (CID 58466910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).