(2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone

C18H22N2O — CID 61073765

IUPAC(2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone
SMILESO=C(c1ccc2cc[nH]c2c1)N1CCCC1C1CCCC1
InChIInChI=1S/C18H22N2O/c21-18(15-8-7-13-9-10-19-16(13)12-15)20-11-3-6-17(20)14-4-1-2-5-14/h7-10,12,14,17,19H,1-6,11H2
InChIKeyQXVUQUDTUFTGKV-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.96
Rot. Bonds2

About (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone

(2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone (PubChem CID 61073765) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone.

Molecular Properties

Compound Name(2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone
PubChem CID61073765
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC Name(2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone
SMILESO=C(c1ccc2cc[nH]c2c1)N1CCCC1C1CCCC1
InChIInChI=1S/C18H22N2O/c21-18(15-8-7-13-9-10-19-16(13)12-15)20-11-3-6-17(20)14-4-1-2-5-14/h7-10,12,14,17,19H,1-6,11H2
InChIKeyQXVUQUDTUFTGKV-UHFFFAOYSA-N
XLogP3.96
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[(4aS,8aS)-2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl]-(1H-indol-6-yl)methanone
CID 94613419
2,3,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazin-4-yl(1H-indol-6-yl)methanone
CID 51088257
[2-(hydroxymethyl)azepan-1-yl]-(1H-indol-6-yl)methanone
CID 116635828
(2R,3R)-1-(1H-indole-6-carbonyl)-2-methylpiperidine-3-carboxylic acid
CID 122116493
[(2R)-2-[(dimethylamino)methyl]piperidin-1-yl]-(1H-indol-6-yl)methanone
CID 95302509
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinoline-1-carbonyl)benzonitrile
CID 17498248
2-(2-cyclopentylpyrrolidine-1-carbonyl)fluoren-9-one
CID 55906672
[(4aS,9aR)-2,3,4,4a,9,9a-hexahydroindeno[2,1-b]pyridin-1-yl]-(1H-indol-5-yl)methanone
CID 67224579
1H-indol-6-yl-[(2R)-2-(1-methylpyrazol-4-yl)pyrrolidin-1-yl]methanone
CID 95340715
1H-indol-6-yl-[(2S)-2-(pyrazol-1-ylmethyl)pyrrolidin-1-yl]methanone
CID 95343101
1-[1-(1H-indole-6-carbonyl)pyrrolidin-2-yl]-N-methylmethanesulfonamide
CID 71862043
3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl-(3-chloro-4-hydroxyphenyl)methanone
CID 43422703

Frequently Asked Questions

What is the IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone?
The IUPAC name of (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone (CID 61073765) is (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone.
What is the SMILES notation for (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone?
The canonical SMILES for (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone is O=C(c1ccc2cc[nH]c2c1)N1CCCC1C1CCCC1.
What is the InChIKey of (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone?
The InChIKey is QXVUQUDTUFTGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c21-18(15-8-7-13-9-10-19-16(13)12-15)20-11-3-6-17(20)14-4-1-2-5-14/h7-10,12,14,17,19H,1-6,11H2.
What are the key properties of (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone?
(2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone has a molecular weight of 282.39 g/mol, XLogP of 3.96, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopentylpyrrolidin-1-yl)-(1H-indol-6-yl)methanone is sourced from PubChem (CID 61073765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).