N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide

C24H29N5O3 — CID 56556717

IUPACN-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(CNC(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)c1
InChIInChI=1S/C24H29N5O3/c1-18(30)26-21-4-2-3-19(15-21)17-25-24(31)27-22-5-6-23-20(16-22)7-8-29(23)10-9-28-11-13-32-14-12-28/h2-8,15-16H,9-14,17H2,1H3,(H,26,30)(H2,25,27,31)
InChIKeyGKXSOLAZEPXLRD-UHFFFAOYSA-N
MW435.53 g/mol
LogP3.25
Rot. Bonds7

About N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide

N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide (PubChem CID 56556717) has the molecular formula C24H29N5O3 and a molecular weight of 435.53 g/mol. Its IUPAC name is N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide
PubChem CID56556717
Molecular FormulaC24H29N5O3
Molecular Weight435.53 g/mol
Exact Mass435.23
IUPAC NameN-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(CNC(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)c1
InChIInChI=1S/C24H29N5O3/c1-18(30)26-21-4-2-3-19(15-21)17-25-24(31)27-22-5-6-23-20(16-22)7-8-29(23)10-9-28-11-13-32-14-12-28/h2-8,15-16H,9-14,17H2,1H3,(H,26,30)(H2,25,27,31)
InChIKeyGKXSOLAZEPXLRD-UHFFFAOYSA-N
XLogP3.25
TPSA87.63 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.53
LogP ≤ 53.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-[(4-chlorophenyl)methyl]-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56549716
1-[1-(2-morpholin-4-ylethyl)indol-5-yl]-3-[(4-propan-2-yloxyphenyl)methyl]urea
CID 56557266
1-hexyl-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56557196
1-[1-(2-morpholin-4-ylethyl)indol-5-yl]-3-(2-morpholin-4-ylpropyl)urea
CID 56556947
1-[1-(2-morpholin-4-ylethyl)indol-5-yl]-3-(4-phenylbutan-2-yl)urea
CID 56557229
1-[2-(3-methoxyphenoxy)ethyl]-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 56556653
1-(3-ethylphenyl)-3-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]urea
CID 48638168
3-amino-2-methyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]butanamide;dihydrochloride
CID 120503366
1-[3-(1-cyclopropyltetrazol-5-yl)phenyl]-3-[1-(2-morpholin-4-ylethyl)indol-5-yl]urea
CID 51134108
4-acetyl-3,5-dimethyl-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]-1H-pyrrole-2-carboxamide
CID 49498040
1-(3,4-dichlorophenyl)-3-[[3-(2-morpholin-4-ylethoxy)phenyl]methyl]urea
CID 60590463
(2R)-N-[1-(2-morpholin-4-ylethyl)indol-5-yl]oxolane-2-carboxamide
CID 94391676

Frequently Asked Questions

What is the IUPAC name of N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide?
The IUPAC name of N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide (CID 56556717) is N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide?
The canonical SMILES for N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide is CC(=O)Nc1cccc(CNC(=O)Nc2ccc3c(ccn3CCN3CCOCC3)c2)c1.
What is the InChIKey of N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide?
The InChIKey is GKXSOLAZEPXLRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H29N5O3/c1-18(30)26-21-4-2-3-19(15-21)17-25-24(31)27-22-5-6-23-20(16-22)7-8-29(23)10-9-28-11-13-32-14-12-28/h2-8,15-16H,9-14,17H2,1H3,(H,26,30)(H2,25,27,31).
What are the key properties of N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide?
N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide has a molecular weight of 435.53 g/mol, XLogP of 3.25, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[[1-(2-morpholin-4-ylethyl)indol-5-yl]carbamoylamino]methyl]phenyl]acetamide is sourced from PubChem (CID 56556717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).