(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide

C23H30N2O2 — CID 30387653

IUPAC(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide
SMILESCC(C)c1ccccc1O[C@H](C)C(=O)NCCCN1CCc2ccccc21
InChIInChI=1S/C23H30N2O2/c1-17(2)20-10-5-7-12-22(20)27-18(3)23(26)24-14-8-15-25-16-13-19-9-4-6-11-21(19)25/h4-7,9-12,17-18H,8,13-16H2,1-3H3,(H,24,26)/t18-/m1/s1
InChIKeyUGUGLKJRSWBUKV-GOSISDBHSA-N
MW366.51 g/mol
LogP4.15
Rot. Bonds8

About (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide

(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide (PubChem CID 30387653) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide
PubChem CID30387653
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC Name(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide
SMILESCC(C)c1ccccc1O[C@H](C)C(=O)NCCCN1CCc2ccccc21
InChIInChI=1S/C23H30N2O2/c1-17(2)20-10-5-7-12-22(20)27-18(3)23(26)24-14-8-15-25-16-13-19-9-4-6-11-21(19)25/h4-7,9-12,17-18H,8,13-16H2,1-3H3,(H,24,26)/t18-/m1/s1
InChIKeyUGUGLKJRSWBUKV-GOSISDBHSA-N
XLogP4.15
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.51
LogP ≤ 54.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(5,6,7,8-tetrahydronaphthalen-1-yloxy)propanamide
CID 100562553
(2S)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2,3,5-trimethylphenoxy)propanamide
CID 28636355
N-[3-(3,4-dihydro-2H-quinolin-1-yl)propyl]-2-(2-methoxyphenoxy)propanamide
CID 132655246
2-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]propanamide
CID 61274113
(2R)-N-(3-morpholin-4-ylpropyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 92679375
2-(2-chlorophenoxy)-N-[3-(2,3-dihydroindol-1-yl)propyl]butanamide
CID 46763359
(2S)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(4-fluorophenoxy)butanamide
CID 94016366
N-(3-propan-2-yloxypropyl)-2-(2-propan-2-ylphenoxy)propanamide
CID 43877163
(2R)-N-ethyl-2-(2-propan-2-ylphenoxy)propanamide
CID 92685149
3-[3-(2,3-dihydroindol-1-yl)propylamino]-3-oxopropanoic acid
CID 62230278
2-amino-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-methylpropanamide
CID 61264292
N-[3-(2,3-dihydroindol-1-yl)propyl]prop-2-enamide
CID 61251337

Frequently Asked Questions

What is the IUPAC name of (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide?
The IUPAC name of (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide (CID 30387653) is (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide?
The canonical SMILES for (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide is CC(C)c1ccccc1O[C@H](C)C(=O)NCCCN1CCc2ccccc21.
What is the InChIKey of (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide?
The InChIKey is UGUGLKJRSWBUKV-GOSISDBHSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-17(2)20-10-5-7-12-22(20)27-18(3)23(26)24-14-8-15-25-16-13-19-9-4-6-11-21(19)25/h4-7,9-12,17-18H,8,13-16H2,1-3H3,(H,24,26)/t18-/m1/s1.
What are the key properties of (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide?
(2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide has a molecular weight of 366.51 g/mol, XLogP of 4.15, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[3-(2,3-dihydroindol-1-yl)propyl]-2-(2-propan-2-ylphenoxy)propanamide is sourced from PubChem (CID 30387653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).