N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide

C16H21N3O2 — CID 138457611

IUPACN-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide
SMILESCc1cc2c(NC(=O)CCN3CCOCC3)cccc2[nH]1
InChIInChI=1S/C16H21N3O2/c1-12-11-13-14(17-12)3-2-4-15(13)18-16(20)5-6-19-7-9-21-10-8-19/h2-4,11,17H,5-10H2,1H3,(H,18,20)
InChIKeyMXWFBMBSOYJKEV-UHFFFAOYSA-N
MW287.36 g/mol
LogP2.14
Rot. Bonds4

About N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide

N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide (PubChem CID 138457611) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide
PubChem CID138457611
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC NameN-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide
SMILESCc1cc2c(NC(=O)CCN3CCOCC3)cccc2[nH]1
InChIInChI=1S/C16H21N3O2/c1-12-11-13-14(17-12)3-2-4-15(13)18-16(20)5-6-19-7-9-21-10-8-19/h2-4,11,17H,5-10H2,1H3,(H,18,20)
InChIKeyMXWFBMBSOYJKEV-UHFFFAOYSA-N
XLogP2.14
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-3-morpholin-4-ylpropanamide
CID 575001
3-morpholin-4-yl-N-[5-(3-morpholin-4-ylpropanoylamino)-9,10-dioxoanthracen-1-yl]propanamide
CID 10815829
N-(1-acetyl-2,3-dihydroindol-7-yl)-3-morpholin-4-ylpropanamide
CID 112537116
N-(2-aminophenyl)-3-(1,4-oxazepan-4-yl)propanamide
CID 55151809
N-(2-methyl-6-propan-2-ylphenyl)-3-morpholin-4-ylpropanamide
CID 47093071
N-(9H-carbazol-2-yl)-4-morpholin-4-ylbutanamide
CID 91294908
N-(2,4-dimethoxyphenyl)-3-morpholin-4-ylpropanamide
CID 772656
N-[4-fluoro-3-(3-morpholin-4-ylpropanoylamino)phenyl]-4,6-dimethyl-1H-indole-2-carboxamide
CID 60554946
N-(2-morpholin-4-ylphenyl)-3-piperidin-1-ylpropanamide
CID 110688369
3-amino-N-[4-fluoro-3-(3-morpholin-4-ylpropanoylamino)phenyl]propanamide
CID 119849282
3-(2-methylmorpholin-4-yl)-N-naphthalen-1-ylpropanamide
CID 46683190
ethyl 5-ethyl-3-(3-morpholin-4-ylpropanoylamino)thiophene-2-carboxylate
CID 171980451

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide?
The IUPAC name of N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide (CID 138457611) is N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide is Cc1cc2c(NC(=O)CCN3CCOCC3)cccc2[nH]1.
What is the InChIKey of N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide?
The InChIKey is MXWFBMBSOYJKEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-12-11-13-14(17-12)3-2-4-15(13)18-16(20)5-6-19-7-9-21-10-8-19/h2-4,11,17H,5-10H2,1H3,(H,18,20).
What are the key properties of N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide?
N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide has a molecular weight of 287.36 g/mol, XLogP of 2.14, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 138457611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).