N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide

C23H23N3O3 — CID 92614865

IUPACN-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide
SMILESO=C(N[C@@H]1CCOc2ccccc21)c1cc(N2CCOCC2)nc2ccccc12
InChIInChI=1S/C23H23N3O3/c27-23(25-20-9-12-29-21-8-4-2-6-17(20)21)18-15-22(26-10-13-28-14-11-26)24-19-7-3-1-5-16(18)19/h1-8,15,20H,9-14H2,(H,25,27)/t20-/m1/s1
InChIKeyALSUJIQVEXQLMC-HXUWFJFHSA-N
MW389.45 g/mol
LogP3.33
Rot. Bonds3

About N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide

N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide (PubChem CID 92614865) has the molecular formula C23H23N3O3 and a molecular weight of 389.45 g/mol. Its IUPAC name is N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide
PubChem CID92614865
Molecular FormulaC23H23N3O3
Molecular Weight389.45 g/mol
Exact Mass389.17
IUPAC NameN-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide
SMILESO=C(N[C@@H]1CCOc2ccccc21)c1cc(N2CCOCC2)nc2ccccc12
InChIInChI=1S/C23H23N3O3/c27-23(25-20-9-12-29-21-8-4-2-6-17(20)21)18-15-22(26-10-13-28-14-11-26)24-19-7-3-1-5-16(18)19/h1-8,15,20H,9-14H2,(H,25,27)/t20-/m1/s1
InChIKeyALSUJIQVEXQLMC-HXUWFJFHSA-N
XLogP3.33
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-methylphenyl)-2-morpholin-4-ylquinoline-4-carboxamide
CID 659672
N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 170948139
2-[4-(4-methoxyphenyl)piperazin-1-yl]-N-(1,2,3,4-tetrahydronaphthalen-1-yl)quinoline-4-carboxamide
CID 46091052
N-benzyl-2-(4-morpholin-4-ylpiperidin-1-yl)quinoline-4-carboxamide
CID 117089548
2-morpholin-4-yl-N-(1-morpholin-4-ylpropan-2-yl)quinoline-4-carboxamide
CID 46975816
N-cyclopropyl-2-[2-(2-methylphenyl)morpholin-4-yl]quinoline-4-carboxamide
CID 133354287
6-(3,5-dichlorophenyl)sulfanyl-N-[(4S)-3,4-dihydro-2H-chromen-4-yl]-4-morpholin-4-ylpyridine-3-carboxamide
CID 163397192
2-[(3S)-3-methylpiperidin-1-yl]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]quinoline-4-carboxamide
CID 129423269
2-(4-morpholin-4-ylpiperidin-1-yl)quinoline-4-carboxamide
CID 117094553
N-(8-chloro-3,4-dihydro-2H-chromen-4-yl)-2-methylquinoline-4-carboxamide
CID 60571804
N-(3-methyl-2-morpholin-4-ylbutyl)-2-morpholin-4-ylquinoline-4-carboxamide
CID 46975815
2-[4-[(1R)-1-morpholin-4-ylethyl]piperidin-1-yl]quinoline-4-carboxylic acid
CID 97200460

Frequently Asked Questions

What is the IUPAC name of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide?
The IUPAC name of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide (CID 92614865) is N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide.
What is the SMILES notation for N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide?
The canonical SMILES for N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide is O=C(N[C@@H]1CCOc2ccccc21)c1cc(N2CCOCC2)nc2ccccc12.
What is the InChIKey of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide?
The InChIKey is ALSUJIQVEXQLMC-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H23N3O3/c27-23(25-20-9-12-29-21-8-4-2-6-17(20)21)18-15-22(26-10-13-28-14-11-26)24-19-7-3-1-5-16(18)19/h1-8,15,20H,9-14H2,(H,25,27)/t20-/m1/s1.
What are the key properties of N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide?
N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide has a molecular weight of 389.45 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4R)-3,4-dihydro-2H-chromen-4-yl]-2-morpholin-4-ylquinoline-4-carboxamide is sourced from PubChem (CID 92614865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).