1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea

C17H23N3O — CID 154503524

IUPAC1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
SMILESCN(CC1(c2cn(C)c3ccccc23)CCCC1)C(N)=O
InChIInChI=1S/C17H23N3O/c1-19-11-14(13-7-3-4-8-15(13)19)17(9-5-6-10-17)12-20(2)16(18)21/h3-4,7-8,11H,5-6,9-10,12H2,1-2H3,(H2,18,21)
InChIKeySRLJJJSVVJOBLV-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.00
Rot. Bonds3

About 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea

1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea (PubChem CID 154503524) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea.

Molecular Properties

Compound Name1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
PubChem CID154503524
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
SMILESCN(CC1(c2cn(C)c3ccccc23)CCCC1)C(N)=O
InChIInChI=1S/C17H23N3O/c1-19-11-14(13-7-3-4-8-15(13)19)17(9-5-6-10-17)12-20(2)16(18)21/h3-4,7-8,11H,5-6,9-10,12H2,1-2H3,(H2,18,21)
InChIKeySRLJJJSVVJOBLV-UHFFFAOYSA-N
XLogP3.00
TPSA51.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,4-difluorophenyl)-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
CID 54003214
[1-(1-methylindol-3-yl)cyclopropyl]methanamine
CID 82278323
2-[1-(1-methylindol-3-yl)cyclopentyl]acetonitrile
CID 10752435
1-(2,6-dichlorophenyl)-3-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea
CID 3072916
1-methyl-1-(1-methylindol-3-yl)urea
CID 115168227
1-[3-(1-methylindol-3-yl)oxetan-3-yl]propan-2-one
CID 116873826
[1-(dimethylamino)cyclopentyl]-(1-methylindol-3-yl)methanone
CID 14069774
1-[methyl-[3-(1-methylindol-3-yl)propanoyl]amino]cyclopentane-1-carboxamide
CID 75498930
2-chloro-N-[[1-(1-methylindol-3-yl)cyclopropyl]methyl]benzamide
CID 113084942
N-[4-[1-[[carbamoyl(methyl)amino]methyl]cyclopentyl]phenyl]-2-phenylacetamide
CID 173174698
2-(1-methylindol-3-yl)-2-oxoacetamide
CID 594179
2-[1-(1-methylindol-3-yl)cyclopropyl]propan-2-amine
CID 83673846

Frequently Asked Questions

What is the IUPAC name of 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea?
The IUPAC name of 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea (CID 154503524) is 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea.
What is the SMILES notation for 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea?
The canonical SMILES for 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea is CN(CC1(c2cn(C)c3ccccc23)CCCC1)C(N)=O.
What is the InChIKey of 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea?
The InChIKey is SRLJJJSVVJOBLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-19-11-14(13-7-3-4-8-15(13)19)17(9-5-6-10-17)12-20(2)16(18)21/h3-4,7-8,11H,5-6,9-10,12H2,1-2H3,(H2,18,21).
What are the key properties of 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea?
1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea has a molecular weight of 285.39 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[[1-(1-methylindol-3-yl)cyclopentyl]methyl]urea is sourced from PubChem (CID 154503524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).