(2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide

C17H23N3O2 — CID 121346580

IUPAC(2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide
SMILESCc1cccn2c(C(C)(C)NC(=O)[C@@H]3CNCCO3)ccc12
InChIInChI=1S/C17H23N3O2/c1-12-5-4-9-20-13(12)6-7-15(20)17(2,3)19-16(21)14-11-18-8-10-22-14/h4-7,9,14,18H,8,10-11H2,1-3H3,(H,19,21)/t14-/m0/s1
InChIKeyLFSNBSNKFGBQKS-AWEZNQCLSA-N
MW301.39 g/mol
LogP1.59
Rot. Bonds3

About (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide

(2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide (PubChem CID 121346580) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide
PubChem CID121346580
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name(2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide
SMILESCc1cccn2c(C(C)(C)NC(=O)[C@@H]3CNCCO3)ccc12
InChIInChI=1S/C17H23N3O2/c1-12-5-4-9-20-13(12)6-7-15(20)17(2,3)19-16(21)14-11-18-8-10-22-14/h4-7,9,14,18H,8,10-11H2,1-3H3,(H,19,21)/t14-/m0/s1
InChIKeyLFSNBSNKFGBQKS-AWEZNQCLSA-N
XLogP1.59
TPSA54.77 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-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 (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide?
The IUPAC name of (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide (CID 121346580) is (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide.
What is the SMILES notation for (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide?
The canonical SMILES for (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide is Cc1cccn2c(C(C)(C)NC(=O)[C@@H]3CNCCO3)ccc12.
What is the InChIKey of (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide?
The InChIKey is LFSNBSNKFGBQKS-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-12-5-4-9-20-13(12)6-7-15(20)17(2,3)19-16(21)14-11-18-8-10-22-14/h4-7,9,14,18H,8,10-11H2,1-3H3,(H,19,21)/t14-/m0/s1.
What are the key properties of (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide?
(2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 1.59, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-(8-methylindolizin-3-yl)propan-2-yl]morpholine-2-carboxamide is sourced from PubChem (CID 121346580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).