2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone

C19H23ClN2O2 — CID 167229545

IUPAC2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone
SMILESCOc1ccc(Cl)c2[nH]c(C(=O)N3CCC4(CCCCC4)C3)cc12
InChIInChI=1S/C19H23ClN2O2/c1-24-16-6-5-14(20)17-13(16)11-15(21-17)18(23)22-10-9-19(12-22)7-3-2-4-8-19/h5-6,11,21H,2-4,7-10,12H2,1H3
InChIKeyNRWNKYGWVWVFDD-UHFFFAOYSA-N
MW346.86 g/mol
LogP4.63
Rot. Bonds2

About 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone

2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone (PubChem CID 167229545) has the molecular formula C19H23ClN2O2 and a molecular weight of 346.86 g/mol. Its IUPAC name is 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone.

Molecular Properties

Compound Name2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone
PubChem CID167229545
Molecular FormulaC19H23ClN2O2
Molecular Weight346.86 g/mol
Exact Mass346.14
IUPAC Name2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone
SMILESCOc1ccc(Cl)c2[nH]c(C(=O)N3CCC4(CCCCC4)C3)cc12
InChIInChI=1S/C19H23ClN2O2/c1-24-16-6-5-14(20)17-13(16)11-15(21-17)18(23)22-10-9-19(12-22)7-3-2-4-8-19/h5-6,11,21H,2-4,7-10,12H2,1H3
InChIKeyNRWNKYGWVWVFDD-UHFFFAOYSA-N
XLogP4.63
TPSA45.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.86
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(7-fluoro-4-methoxy-1H-indol-2-yl)-[4-hydroxy-4-(methoxymethyl)piperidin-1-yl]methanone
CID 139007473
methyl (2S)-2-[[2-(7-chloro-4-methoxy-1H-indole-2-carbonyl)-2-azaspiro[4.5]decane-3-carbonyl]amino]-3-[(1S)-2-oxocyclohexyl]propanoate
CID 163743601
2-(7-chloro-4-methoxy-1H-indole-2-carbonyl)-N-[1-cyano-2-[(3S)-2-oxopyrrolidin-3-yl]ethyl]-2-azaspiro[4.5]decane-3-carboxamide
CID 175871132
(4-amino-5-chloro-2-methoxyphenyl)-(2-azaspiro[5.5]undecan-2-yl)methanone
CID 119784783
(7-fluoro-4-methoxy-1H-indol-2-yl)-(2,2,6,6-tetramethylmorpholin-4-yl)methanone
CID 136538978
2-azaspiro[4.5]decan-2-yl-(6-methoxypyridazin-3-yl)methanone
CID 71873411
(2-methoxy-5-methylphenyl)-(8-methyl-2,8-diazaspiro[4.5]decan-2-yl)methanone
CID 112534319
(E)-1-(6-azaspiro[3.4]octan-6-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-en-1-one
CID 171678586
(5-amino-2-methoxyphenyl)-(8-azaspiro[4.5]decan-8-yl)methanone
CID 63156948
2-azaspiro[3.4]octan-2-yl-(5-chloro-6,7-difluoro-1H-indol-2-yl)methanone
CID 157202078
1,4-dioxa-8-azaspiro[4.5]decan-8-yl-(4,5,6-trimethoxy-1H-indol-2-yl)methanone
CID 4893817
1-[8-(2-chloro-6-methoxypyridine-4-carbonyl)-2,8-diazaspiro[4.5]decan-2-yl]-2-(2,3,4-trimethoxyphenyl)ethanone
CID 3815535

Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone?
The IUPAC name of 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone (CID 167229545) is 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone.
What is the SMILES notation for 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone?
The canonical SMILES for 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone is COc1ccc(Cl)c2[nH]c(C(=O)N3CCC4(CCCCC4)C3)cc12.
What is the InChIKey of 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone?
The InChIKey is NRWNKYGWVWVFDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23ClN2O2/c1-24-16-6-5-14(20)17-13(16)11-15(21-17)18(23)22-10-9-19(12-22)7-3-2-4-8-19/h5-6,11,21H,2-4,7-10,12H2,1H3.
What are the key properties of 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone?
2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone has a molecular weight of 346.86 g/mol, XLogP of 4.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[4.5]decan-2-yl-(7-chloro-4-methoxy-1H-indol-2-yl)methanone is sourced from PubChem (CID 167229545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).