N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride

C16H25Cl2N3O2 — CID 119856776

IUPACN-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride
SMILESCC(CNC(=O)C1COCCN1)N1CCc2ccccc21.Cl.Cl
InChIInChI=1S/C16H23N3O2.2ClH/c1-12(10-18-16(20)14-11-21-9-7-17-14)19-8-6-13-4-2-3-5-15(13)19;;/h2-5,12,14,17H,6-11H2,1H3,(H,18,20);2*1H
InChIKeyUAXWUQUIAJCVAV-UHFFFAOYSA-N
MW362.30 g/mol
LogP1.39
Rot. Bonds4

About N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride

N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride (PubChem CID 119856776) has the molecular formula C16H25Cl2N3O2 and a molecular weight of 362.30 g/mol. Its IUPAC name is N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride.

Molecular Properties

Compound NameN-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride
PubChem CID119856776
Molecular FormulaC16H25Cl2N3O2
Molecular Weight362.30 g/mol
Exact Mass361.13
IUPAC NameN-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride
SMILESCC(CNC(=O)C1COCCN1)N1CCc2ccccc21.Cl.Cl
InChIInChI=1S/C16H23N3O2.2ClH/c1-12(10-18-16(20)14-11-21-9-7-17-14)19-8-6-13-4-2-3-5-15(13)19;;/h2-5,12,14,17H,6-11H2,1H3,(H,18,20);2*1H
InChIKeyUAXWUQUIAJCVAV-UHFFFAOYSA-N
XLogP1.39
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.30
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(2,3-dihydroindol-1-yl)propyl]-4-hydroxypyrrolidine-2-carboxamide;dihydrochloride
CID 119856800
N-(2-phenyl-2-pyrrolidin-1-ylethyl)morpholine-3-carboxamide;dihydrochloride
CID 119831374
N-(2-phenylsulfanylpropyl)morpholine-3-carboxamide;hydrochloride
CID 119804403
N-[4-(2,3-dihydroindol-1-ylmethyl)phenyl]morpholine-3-carboxamide;dihydrochloride
CID 119866777
2,3-dihydroindol-1-yl(morpholin-3-yl)methanone;hydrochloride
CID 119673083
N-[2-(4-methylpiperidin-1-yl)-2-phenylethyl]morpholine-3-carboxamide;dihydrochloride
CID 119860439
(3S)-1-acetyl-N-[(2S)-2-(2,3-dihydroindol-1-yl)propyl]piperidine-3-carboxamide
CID 51725598
4-amino-N-[2-(2,3-dihydroindol-1-yl)propyl]pentanamide;dihydrochloride
CID 120564829
N-[2-(4-methylphenyl)-2-pyrrolidin-1-ylethyl]morpholine-3-carboxamide;dihydrochloride
CID 119866459
2-amino-N-[2-(2,3-dihydroindol-1-yl)propyl]benzamide;dihydrochloride
CID 119946701
N-[2-(2-fluorophenoxy)propyl]morpholine-3-carboxamide
CID 119804849
(2S)-N-[(2R)-2-(2,3-dihydroindol-1-yl)propyl]-2-methylsulfonylpropanamide
CID 94028724

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride?
The IUPAC name of N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride (CID 119856776) is N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride.
What is the SMILES notation for N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride?
The canonical SMILES for N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride is CC(CNC(=O)C1COCCN1)N1CCc2ccccc21.Cl.Cl.
What is the InChIKey of N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride?
The InChIKey is UAXWUQUIAJCVAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2.2ClH/c1-12(10-18-16(20)14-11-21-9-7-17-14)19-8-6-13-4-2-3-5-15(13)19;;/h2-5,12,14,17H,6-11H2,1H3,(H,18,20);2*1H.
What are the key properties of N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride?
N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride has a molecular weight of 362.30 g/mol, XLogP of 1.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,3-dihydroindol-1-yl)propyl]morpholine-3-carboxamide;dihydrochloride is sourced from PubChem (CID 119856776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).