(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide

C19H26N4O — CID 97194945

IUPAC(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
SMILESCC(C)c1nccn1[C@H](C)C(=O)NCCN1CCc2ccccc21
InChIInChI=1S/C19H26N4O/c1-14(2)18-20-10-13-23(18)15(3)19(24)21-9-12-22-11-8-16-6-4-5-7-17(16)22/h4-7,10,13-15H,8-9,11-12H2,1-3H3,(H,21,24)/t15-/m1/s1
InChIKeyKHEOWMMBTPMJRP-OAHLLOKOSA-N
MW326.44 g/mol
LogP2.75
Rot. Bonds6

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

(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide (PubChem CID 97194945) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide.

Molecular Properties

Compound Name(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
PubChem CID97194945
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
SMILESCC(C)c1nccn1[C@H](C)C(=O)NCCN1CCc2ccccc21
InChIInChI=1S/C19H26N4O/c1-14(2)18-20-10-13-23(18)15(3)19(24)21-9-12-22-11-8-16-6-4-5-7-17(16)22/h4-7,10,13-15H,8-9,11-12H2,1-3H3,(H,21,24)/t15-/m1/s1
InChIKeyKHEOWMMBTPMJRP-OAHLLOKOSA-N
XLogP2.75
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 72890918
N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-methyl-3-phenylpropanamide
CID 110353132
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CID 110620139
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cis-(1S,3R)-3-[2-(2,3-dihydroindol-1-yl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 133134060
N-[2-(4-fluorophenyl)sulfonylethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide
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2-(2-propan-2-ylimidazol-1-yl)-N-[2-(2H-triazol-4-ylsulfanyl)ethyl]propanamide
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Frequently Asked Questions

What is the IUPAC name of (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide?
The IUPAC name of (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide (CID 97194945) is (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide.
What is the SMILES notation for (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide?
The canonical SMILES for (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide is CC(C)c1nccn1[C@H](C)C(=O)NCCN1CCc2ccccc21.
What is the InChIKey of (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide?
The InChIKey is KHEOWMMBTPMJRP-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H26N4O/c1-14(2)18-20-10-13-23(18)15(3)19(24)21-9-12-22-11-8-16-6-4-5-7-17(16)22/h4-7,10,13-15H,8-9,11-12H2,1-3H3,(H,21,24)/t15-/m1/s1.
What are the key properties of (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide?
(2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide has a molecular weight of 326.44 g/mol, XLogP of 2.75, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-[2-(2,3-dihydroindol-1-yl)ethyl]-2-(2-propan-2-ylimidazol-1-yl)propanamide is sourced from PubChem (CID 97194945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).