(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide

C17H23N3O2 — CID 95760502

IUPAC(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide
SMILESCc1cccc2[nH]cc(CCNC(=O)N3CCO[C@H](C)C3)c12
InChIInChI=1S/C17H23N3O2/c1-12-4-3-5-15-16(12)14(10-19-15)6-7-18-17(21)20-8-9-22-13(2)11-20/h3-5,10,13,19H,6-9,11H2,1-2H3,(H,18,21)/t13-/m1/s1
InChIKeyKDPODZPDRQIEMY-CYBMUJFWSA-N
MW301.39 g/mol
LogP2.45
Rot. Bonds3

About (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide

(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide (PubChem CID 95760502) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide.

Molecular Properties

Compound Name(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide
PubChem CID95760502
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide
SMILESCc1cccc2[nH]cc(CCNC(=O)N3CCO[C@H](C)C3)c12
InChIInChI=1S/C17H23N3O2/c1-12-4-3-5-15-16(12)14(10-19-15)6-7-18-17(21)20-8-9-22-13(2)11-20/h3-5,10,13,19H,6-9,11H2,1-2H3,(H,18,21)/t13-/m1/s1
InChIKeyKDPODZPDRQIEMY-CYBMUJFWSA-N
XLogP2.45
TPSA57.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(hydroxymethyl)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]pyrrolidine-1-carboxamide
CID 111444019
(2S)-4-[2-(4-methyl-1H-indol-3-yl)acetyl]morpholine-2-carboxylic acid
CID 124697408
N-[2-(4-methyl-1H-indol-3-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
CID 167750936
2-(cyclopropylmethylamino)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]acetamide
CID 119774526
2-(methylamino)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]acetamide
CID 119774518
N-[2-(4-methyl-1H-indol-3-yl)ethyl]-2-(1H-pyrrol-2-yl)pyrrolidine-1-carboxamide
CID 167756273
4-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
CID 167808661
1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopropane-1-carboxamide
CID 119774498
1-hydroxy-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
CID 110932725
1-amino-N-[2-(4-methyl-1H-indol-3-yl)ethyl]cyclopentane-1-carboxamide
CID 119318274
4-(aminomethyl)-N-[2-(4-methyl-1H-indol-3-yl)ethyl]oxane-4-carboxamide
CID 120931113
3-(hydroxymethyl)-N-[2-(4-methoxy-1H-indol-3-yl)ethyl]pyrrolidine-1-carboxamide
CID 84597590

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide?
The IUPAC name of (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide (CID 95760502) is (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide.
What is the SMILES notation for (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide?
The canonical SMILES for (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide is Cc1cccc2[nH]cc(CCNC(=O)N3CCO[C@H](C)C3)c12.
What is the InChIKey of (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide?
The InChIKey is KDPODZPDRQIEMY-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-12-4-3-5-15-16(12)14(10-19-15)6-7-18-17(21)20-8-9-22-13(2)11-20/h3-5,10,13,19H,6-9,11H2,1-2H3,(H,18,21)/t13-/m1/s1.
What are the key properties of (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide?
(2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide has a molecular weight of 301.39 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-N-[2-(4-methyl-1H-indol-3-yl)ethyl]morpholine-4-carboxamide is sourced from PubChem (CID 95760502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).