N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide

C24H28N4O3 — CID 12003070

IUPACN-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide
SMILESCc1nc2c3c(c(C(=O)NCC(O)CO)cn2c1C)CCC1(Cc2ccccc2C1)N3
InChIInChI=1S/C24H28N4O3/c1-14-15(2)28-12-20(23(31)25-11-18(30)13-29)19-7-8-24(27-21(19)22(28)26-14)9-16-5-3-4-6-17(16)10-24/h3-6,12,18,27,29-30H,7-11,13H2,1-2H3,(H,25,31)
InChIKeyFGSYOAXAZOWLRR-UHFFFAOYSA-N
MW420.51 g/mol
LogP1.93
Rot. Bonds4

About N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide

N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide (PubChem CID 12003070) has the molecular formula C24H28N4O3 and a molecular weight of 420.51 g/mol. Its IUPAC name is N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide
PubChem CID12003070
Molecular FormulaC24H28N4O3
Molecular Weight420.51 g/mol
Exact Mass420.22
IUPAC NameN-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide
SMILESCc1nc2c3c(c(C(=O)NCC(O)CO)cn2c1C)CCC1(Cc2ccccc2C1)N3
InChIInChI=1S/C24H28N4O3/c1-14-15(2)28-12-20(23(31)25-11-18(30)13-29)19-7-8-24(27-21(19)22(28)26-14)9-16-5-3-4-6-17(16)10-24/h3-6,12,18,27,29-30H,7-11,13H2,1-2H3,(H,25,31)
InChIKeyFGSYOAXAZOWLRR-UHFFFAOYSA-N
XLogP1.93
TPSA98.89 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 51.93
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Analyze N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide with MolForge

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Related Compounds

azetidin-1-yl-(2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-yl)methanone
CID 12002988
(9S)-N-(2-hydroxyethyl)-2,3-dimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[1,2-h][1,7]naphthyridine-6-carboxamide
CID 11233848
N,2,3-trimethyl-9-phenyl-7,8,9,10-tetrahydroimidazo[1,2-h][1,7]naphthyridine-6-carboxamide
CID 11359568
N,2',3'-trimethylspiro[1,3-dihydroindene-2,8'-7,9-dihydro-6H-imidazo[4,5-h]quinoline]-5'-carboxamide
CID 11983211
N-cyclopropyl-2'-methylspiro[1,3-dihydroindene-2,8'-3,6,7,9-tetrahydroimidazo[4,5-h]quinoline]-5'-carboxamide
CID 15980066
8-(2,3-dihydroxypropylcarbamoyl)naphthalene-1-carboxylic acid
CID 66178018
N-(2,3-dihydroxypropyl)-2,3-dihydroxybenzamide
CID 114344939
N-[(2S)-2,3-dihydroxypropyl]-3-methylbenzamide
CID 40653428
N-[(2S)-2,3-dihydroxypropyl]-1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxamide
CID 97003402
N-[(2R)-2,3-dihydroxypropyl]-1-(4-fluorophenyl)-2,5-dimethylpyrrole-3-carboxamide
CID 97003403
N-[(2S)-2,3-dihydroxypropyl]-3-(2,6-dimethyl-3-pyridinyl)-5-fluorobenzamide
CID 169418400
N-(2,3-dihydroxypropyl)-2-(trifluoromethyl)benzamide
CID 66175998

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide?
The IUPAC name of N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide (CID 12003070) is N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide.
What is the SMILES notation for N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide?
The canonical SMILES for N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide is Cc1nc2c3c(c(C(=O)NCC(O)CO)cn2c1C)CCC1(Cc2ccccc2C1)N3.
What is the InChIKey of N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide?
The InChIKey is FGSYOAXAZOWLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O3/c1-14-15(2)28-12-20(23(31)25-11-18(30)13-29)19-7-8-24(27-21(19)22(28)26-14)9-16-5-3-4-6-17(16)10-24/h3-6,12,18,27,29-30H,7-11,13H2,1-2H3,(H,25,31).
What are the key properties of N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide?
N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide has a molecular weight of 420.51 g/mol, XLogP of 1.93, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydroxypropyl)-2',3'-dimethylspiro[1,3-dihydroindene-2,9'-8,10-dihydro-7H-imidazo[1,2-h][1,7]naphthyridine]-6'-carboxamide is sourced from PubChem (CID 12003070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).