2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide

C24H30N4O2 — CID 56536378

IUPAC2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
SMILESCn1cc(CC(=O)N(CCCN2CCOCC2)Cc2ccncc2)c2ccccc21
InChIInChI=1S/C24H30N4O2/c1-26-19-21(22-5-2-3-6-23(22)26)17-24(29)28(18-20-7-9-25-10-8-20)12-4-11-27-13-15-30-16-14-27/h2-3,5-10,19H,4,11-18H2,1H3
InChIKeyOCLTXQIUPYKGFN-UHFFFAOYSA-N
MW406.53 g/mol
LogP2.87
Rot. Bonds8

About 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide

2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide (PubChem CID 56536378) has the molecular formula C24H30N4O2 and a molecular weight of 406.53 g/mol. Its IUPAC name is 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
PubChem CID56536378
Molecular FormulaC24H30N4O2
Molecular Weight406.53 g/mol
Exact Mass406.24
IUPAC Name2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
SMILESCn1cc(CC(=O)N(CCCN2CCOCC2)Cc2ccncc2)c2ccccc21
InChIInChI=1S/C24H30N4O2/c1-26-19-21(22-5-2-3-6-23(22)26)17-24(29)28(18-20-7-9-25-10-8-20)12-4-11-27-13-15-30-16-14-27/h2-3,5-10,19H,4,11-18H2,1H3
InChIKeyOCLTXQIUPYKGFN-UHFFFAOYSA-N
XLogP2.87
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.53
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-morpholin-4-ylpropyl)-4-naphthalen-1-yloxy-N-(pyridin-4-ylmethyl)butanamide
CID 56564245
2-(2-methyl-4-oxoquinazolin-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
CID 56564495
2-(1-methylindol-3-yl)-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)acetamide
CID 90607262
N-methyl-N-[2-[3-morpholin-4-ylpropyl(pyridin-4-ylmethyl)amino]-2-oxoethyl]thiophene-2-carboxamide
CID 56536390
N-(3-morpholin-4-ylpropyl)-2-(2-propan-2-yl-1,3-thiazol-4-yl)-N-(pyridin-4-ylmethyl)acetamide
CID 56564590
N-(3-morpholin-4-ylpropyl)-3-(1-phenylbenzimidazol-2-yl)-N-(pyridin-4-ylmethyl)propanamide
CID 55436371
2-(4-tert-butylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide
CID 56564277
N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 56564212
N-(3-morpholin-4-ylpropyl)-4-(5-phenyl-1,3-oxazol-2-yl)-N-(pyridin-4-ylmethyl)butanamide
CID 56564213
3-(3,4-dimethylphenyl)sulfanyl-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)propanamide
CID 56536604
3-(3-ethylphenyl)-1-[(1-methylindol-3-yl)methyl]-1-(3-morpholin-4-ylpropyl)thiourea
CID 53204635
3-(2,4-dimethylphenoxy)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)propanamide
CID 56536360

Frequently Asked Questions

What is the IUPAC name of 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
The IUPAC name of 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide (CID 56536378) is 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide is Cn1cc(CC(=O)N(CCCN2CCOCC2)Cc2ccncc2)c2ccccc21.
What is the InChIKey of 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
The InChIKey is OCLTXQIUPYKGFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O2/c1-26-19-21(22-5-2-3-6-23(22)26)17-24(29)28(18-20-7-9-25-10-8-20)12-4-11-27-13-15-30-16-14-27/h2-3,5-10,19H,4,11-18H2,1H3.
What are the key properties of 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide?
2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide has a molecular weight of 406.53 g/mol, XLogP of 2.87, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylindol-3-yl)-N-(3-morpholin-4-ylpropyl)-N-(pyridin-4-ylmethyl)acetamide is sourced from PubChem (CID 56536378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).