1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one

C20H22ClN3O2 — CID 162628262

IUPAC1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one
SMILESO=C(c1cc2c(Cl)cccc2[nH]1)N1CCCC12CCCN(C1CC1)C2=O
InChIInChI=1S/C20H22ClN3O2/c21-15-4-1-5-16-14(15)12-17(22-16)18(25)24-11-3-9-20(24)8-2-10-23(19(20)26)13-6-7-13/h1,4-5,12-13,22H,2-3,6-11H2
InChIKeyLDCLFJGUORXAIT-UHFFFAOYSA-N
MW371.87 g/mol
LogP3.58
Rot. Bonds2

About 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one

1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one (PubChem CID 162628262) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one.

Molecular Properties

Compound Name1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one
PubChem CID162628262
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC Name1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one
SMILESO=C(c1cc2c(Cl)cccc2[nH]1)N1CCCC12CCCN(C1CC1)C2=O
InChIInChI=1S/C20H22ClN3O2/c21-15-4-1-5-16-14(15)12-17(22-16)18(25)24-11-3-9-20(24)8-2-10-23(19(20)26)13-6-7-13/h1,4-5,12-13,22H,2-3,6-11H2
InChIKeyLDCLFJGUORXAIT-UHFFFAOYSA-N
XLogP3.58
TPSA56.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one with MolForge

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Related Compounds

1-(2-chloro-6-fluorobenzoyl)-9-(4-hydroxycyclohexyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162625884
1-(2-chloro-5-methylbenzoyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one
CID 163317759
azetidin-1-yl-(4-chloro-1H-indol-2-yl)methanone
CID 167907926
1-(4-chlorobenzoyl)-9-(4-hydroxycyclohexyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162637440
9-(4-hydroxycyclohexyl)-1-(6-oxo-1H-pyrazine-2-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162637036
3-[9-(4-hydroxycyclohexyl)-10-oxo-1,9-diazaspiro[4.5]decane-1-carbonyl]benzonitrile
CID 162628283
(4-chloro-1H-indol-2-yl)-(4-methylpiperazin-1-yl)methanone
CID 66572106
1-acetyl-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one
CID 163307131
9-cyclopropyl-1-(1-methylindole-3-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162638778
9-cyclopropyl-1-[3-(3-methoxyphenyl)benzoyl]-1,9-diazaspiro[4.5]decan-10-one
CID 162637277
9-(4-hydroxycyclohexyl)-1-(6-oxo-1H-pyrimidine-5-carbonyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162638280
1-(1H-indole-2-carbonyl)-9-(2-phenylethyl)-1,9-diazaspiro[4.5]decan-10-one
CID 162626984

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one?
The IUPAC name of 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one (CID 162628262) is 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one.
What is the SMILES notation for 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one?
The canonical SMILES for 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one is O=C(c1cc2c(Cl)cccc2[nH]1)N1CCCC12CCCN(C1CC1)C2=O.
What is the InChIKey of 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one?
The InChIKey is LDCLFJGUORXAIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c21-15-4-1-5-16-14(15)12-17(22-16)18(25)24-11-3-9-20(24)8-2-10-23(19(20)26)13-6-7-13/h1,4-5,12-13,22H,2-3,6-11H2.
What are the key properties of 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one?
1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one has a molecular weight of 371.87 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-1H-indole-2-carbonyl)-9-cyclopropyl-1,9-diazaspiro[4.5]decan-10-one is sourced from PubChem (CID 162628262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).