N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide

C19H27N3O3 — CID 111912425

IUPACN-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide
SMILESCc1cc(C)c2cc(C(=O)N(C)CC(O)CN3CCOCC3)[nH]c2c1
InChIInChI=1S/C19H27N3O3/c1-13-8-14(2)16-10-18(20-17(16)9-13)19(24)21(3)11-15(23)12-22-4-6-25-7-5-22/h8-10,15,20,23H,4-7,11-12H2,1-3H3
InChIKeyLKSFLELFCVHPEL-UHFFFAOYSA-N
MW345.44 g/mol
LogP1.55
Rot. Bonds5

About N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide

N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide (PubChem CID 111912425) has the molecular formula C19H27N3O3 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide
PubChem CID111912425
Molecular FormulaC19H27N3O3
Molecular Weight345.44 g/mol
Exact Mass345.21
IUPAC NameN-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide
SMILESCc1cc(C)c2cc(C(=O)N(C)CC(O)CN3CCOCC3)[nH]c2c1
InChIInChI=1S/C19H27N3O3/c1-13-8-14(2)16-10-18(20-17(16)9-13)19(24)21(3)11-15(23)12-22-4-6-25-7-5-22/h8-10,15,20,23H,4-7,11-12H2,1-3H3
InChIKeyLKSFLELFCVHPEL-UHFFFAOYSA-N
XLogP1.55
TPSA68.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide?
The IUPAC name of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide (CID 111912425) is N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide is Cc1cc(C)c2cc(C(=O)N(C)CC(O)CN3CCOCC3)[nH]c2c1.
What is the InChIKey of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide?
The InChIKey is LKSFLELFCVHPEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3O3/c1-13-8-14(2)16-10-18(20-17(16)9-13)19(24)21(3)11-15(23)12-22-4-6-25-7-5-22/h8-10,15,20,23H,4-7,11-12H2,1-3H3.
What are the key properties of N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide?
N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide has a molecular weight of 345.44 g/mol, XLogP of 1.55, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxy-3-morpholin-4-ylpropyl)-N,4,6-trimethyl-1H-indole-2-carboxamide is sourced from PubChem (CID 111912425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).