5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine

C26H33N5 — CID 177173548

IUPAC5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine
SMILESCCc1ccc2c(N3CCC4(CCCNC4)C3)cc(-c3ccc(N(C)C)nc3)nc2c1
InChIInChI=1S/C26H33N5/c1-4-19-6-8-21-23(14-19)29-22(20-7-9-25(28-16-20)30(2)3)15-24(21)31-13-11-26(18-31)10-5-12-27-17-26/h6-9,14-16,27H,4-5,10-13,17-18H2,1-3H3
InChIKeyWQAAGTIPGKUMGZ-UHFFFAOYSA-N
MW415.59 g/mol
LogP4.51
Rot. Bonds4

About 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine

5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine (PubChem CID 177173548) has the molecular formula C26H33N5 and a molecular weight of 415.59 g/mol. Its IUPAC name is 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine
PubChem CID177173548
Molecular FormulaC26H33N5
Molecular Weight415.59 g/mol
Exact Mass415.27
IUPAC Name5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine
SMILESCCc1ccc2c(N3CCC4(CCCNC4)C3)cc(-c3ccc(N(C)C)nc3)nc2c1
InChIInChI=1S/C26H33N5/c1-4-19-6-8-21-23(14-19)29-22(20-7-9-25(28-16-20)30(2)3)15-24(21)31-13-11-26(18-31)10-5-12-27-17-26/h6-9,14-16,27H,4-5,10-13,17-18H2,1-3H3
InChIKeyWQAAGTIPGKUMGZ-UHFFFAOYSA-N
XLogP4.51
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.59
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine with MolForge

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Related Compounds

2-(5-ethylpyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 56756393
N,N-dimethyl-2-[6-[2-(methylamino)ethoxy]-3-pyridinyl]-4-(2-oxa-7-azaspiro[3.4]octan-7-yl)quinolin-7-amine
CID 177173317
(5S)-2-(4-methylpyrimidin-2-yl)-2,9-diazaspiro[4.5]decane
CID 95222078
1-[[4-[4-(6-azaspiro[3.4]octan-6-yl)-7-methoxyquinolin-2-yl]phenoxy]methyl]-N-methylcyclopropan-1-amine;molecular hydrogen
CID 177173257
3-[4-[4-(3a-fluoro-4-methylidene-1,3,5,6,7,7a-hexahydropyrrolo[3,4-c]pyridin-2-yl)-7-ethylquinolin-2-yl]phenyl]-N-methylpropan-1-amine;ethane
CID 177173783
2-pyrazin-2-yl-2,9-diazaspiro[4.5]decane
CID 56750395
(5S)-2-pyrazin-2-yl-2,9-diazaspiro[4.5]decane
CID 95203740
2-[2-[6-(azetidin-1-yl)-1,2-dihydropyridin-3-yl]-6-fluoro-7-methoxyquinolin-4-yl]-2,9-diazaspiro[4.5]decane
CID 177173191
5-(2,7-diazaspiro[4.4]nonan-2-ylmethyl)-N-ethyl-N-methylpyridin-2-amine;hydrochloride
CID 120908695
4-(3-methoxypyrrolidin-1-yl)-N,N-dimethyl-2-(6-piperazin-1-yl-3-pyridinyl)quinolin-7-amine
CID 177174244
[4-(2,9-diazaspiro[4.5]decan-2-yl)-6-methylpyrimidin-2-yl]methanol
CID 166266789
2-[4-[4-(2,2-dioxo-2λ6-thia-7-azaspiro[3.4]octan-7-yl)-6-fluoro-7-methoxyquinolin-2-yl]phenoxy]-N,N-dimethylethanamine
CID 177173101

Frequently Asked Questions

What is the IUPAC name of 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine (CID 177173548) is 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine is CCc1ccc2c(N3CCC4(CCCNC4)C3)cc(-c3ccc(N(C)C)nc3)nc2c1.
What is the InChIKey of 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine?
The InChIKey is WQAAGTIPGKUMGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H33N5/c1-4-19-6-8-21-23(14-19)29-22(20-7-9-25(28-16-20)30(2)3)15-24(21)31-13-11-26(18-31)10-5-12-27-17-26/h6-9,14-16,27H,4-5,10-13,17-18H2,1-3H3.
What are the key properties of 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine?
5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine has a molecular weight of 415.59 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(2,9-diazaspiro[4.5]decan-2-yl)-7-ethylquinolin-2-yl]-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 177173548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).