(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone

C15H18N2O — CID 7329070

IUPAC(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone
SMILESCc1ccc2c(c1)cc(C(=O)N1CCCC1)n2C
InChIInChI=1S/C15H18N2O/c1-11-5-6-13-12(9-11)10-14(16(13)2)15(18)17-7-3-4-8-17/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyUQENOTNAMYIZQV-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.72
Rot. Bonds1

About (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone

(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone (PubChem CID 7329070) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone.

Molecular Properties

Compound Name(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone
PubChem CID7329070
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone
SMILESCc1ccc2c(c1)cc(C(=O)N1CCCC1)n2C
InChIInChI=1S/C15H18N2O/c1-11-5-6-13-12(9-11)10-14(16(13)2)15(18)17-7-3-4-8-17/h5-6,9-10H,3-4,7-8H2,1-2H3
InChIKeyUQENOTNAMYIZQV-UHFFFAOYSA-N
XLogP2.72
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1,5-dimethylindol-2-yl)-piperazin-1-ylmethanone
CID 110833415
(1,5-dimethylindol-2-yl)-(4-pyrrolidin-1-ylsulfonylpiperazin-1-yl)methanone
CID 46977726
(1,5-dimethylindol-2-yl)-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)methanone
CID 110853525
azetidin-1-yl-(5-chloro-1-methylindol-2-yl)methanone
CID 141372490
[4-(1,5-dimethylindole-2-carbonyl)morpholin-2-yl]-piperidin-1-ylmethanone
CID 110246401
[(2S)-4-(1,5-dimethylindole-2-carbonyl)morpholin-2-yl]-piperidin-1-ylmethanone
CID 92632990
(1,5-dimethylindol-2-yl)-(4-morpholin-4-ylsulfonylpiperazin-1-yl)methanone
CID 46979809
(1,5-dimethylindol-2-yl)-[4-[(5-methylfuran-2-yl)methyl]-1,4-diazepan-1-yl]methanone
CID 134706914
1,5-dimethyl-N-pyrrolidin-1-ylsulfonylindole-2-carboxamide
CID 118100925
(2R)-4-(1,5-dimethylindole-2-carbonyl)-N,N,2-trimethylmorpholine-2-carboxamide
CID 92632573
(1,5-dimethylindol-2-yl)-[(2R)-2-(4-methoxyphenyl)azepan-1-yl]methanone
CID 124582318
[5-(3,5-dimethylpiperidin-1-yl)sulfinyl-1-methylindol-2-yl]-piperidin-1-ylmethanone
CID 143170987

Frequently Asked Questions

What is the IUPAC name of (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone?
The IUPAC name of (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone (CID 7329070) is (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone.
What is the SMILES notation for (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone?
The canonical SMILES for (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone is Cc1ccc2c(c1)cc(C(=O)N1CCCC1)n2C.
What is the InChIKey of (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone?
The InChIKey is UQENOTNAMYIZQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-5-6-13-12(9-11)10-14(16(13)2)15(18)17-7-3-4-8-17/h5-6,9-10H,3-4,7-8H2,1-2H3.
What are the key properties of (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone?
(1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone has a molecular weight of 242.32 g/mol, XLogP of 2.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,5-dimethylindol-2-yl)-pyrrolidin-1-ylmethanone is sourced from PubChem (CID 7329070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).