N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide

C25H27N3O4 — CID 126473227

IUPACN-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide
SMILESCOc1ccc2[nH]c3c(c2c1)CCOC31CCN(C(=O)Nc2ccc(C(C)=O)cc2)CC1
InChIInChI=1S/C25H27N3O4/c1-16(29)17-3-5-18(6-4-17)26-24(30)28-12-10-25(11-13-28)23-20(9-14-32-25)21-15-19(31-2)7-8-22(21)27-23/h3-8,15,27H,9-14H2,1-2H3,(H,26,30)
InChIKeyMEPYCAKFPWTAJK-UHFFFAOYSA-N
MW433.51 g/mol
LogP4.47
Rot. Bonds3

About N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide

N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide (PubChem CID 126473227) has the molecular formula C25H27N3O4 and a molecular weight of 433.51 g/mol. Its IUPAC name is N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide
PubChem CID126473227
Molecular FormulaC25H27N3O4
Molecular Weight433.51 g/mol
Exact Mass433.20
IUPAC NameN-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide
SMILESCOc1ccc2[nH]c3c(c2c1)CCOC31CCN(C(=O)Nc2ccc(C(C)=O)cc2)CC1
InChIInChI=1S/C25H27N3O4/c1-16(29)17-3-5-18(6-4-17)26-24(30)28-12-10-25(11-13-28)23-20(9-14-32-25)21-15-19(31-2)7-8-22(21)27-23/h3-8,15,27H,9-14H2,1-2H3,(H,26,30)
InChIKeyMEPYCAKFPWTAJK-UHFFFAOYSA-N
XLogP4.47
TPSA83.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.51
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(3-methoxy-4-methylphenyl)-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylmethanone
CID 135120527
6-methoxy-1-methyl-2,3,4,9-tetrahydrocarbazole-1-carboxylic acid
CID 84742547
N-(3-methoxyphenyl)spiro[6,7-dihydrothieno[3,2-c]pyran-4,4'-piperidine]-1'-carboxamide
CID 135094445
2-(2-methoxyphenoxy)-1-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylethanone
CID 135112568
cyclobutyl-(6-methoxy-2-methylspiro[4,9-dihydro-3H-pyrido[3,4-b]indole-1,4'-piperidine]-1'-yl)methanone
CID 110197664
methyl 2-(1-ethyl-6-methoxy-2,3,4,9-tetrahydrocarbazol-1-yl)acetate
CID 54177477
1-[5-(spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carbonyl)thiophen-2-yl]ethanone
CID 135119539
N-(4-acetylphenyl)-4-hydroxy-4-methylazepane-1-carboxamide
CID 107406879
N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide
CID 169490460
acetic acid;3-amino-1-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylpropan-1-one
CID 154916173
6-methoxy-1-methylidene-N-phenyl-4,9-dihydro-3H-pyrido[3,4-b]indole-2-carboxamide
CID 18794229
N-(4-methoxyphenyl)-2,8-diazaspiro[4.5]decane-8-carboxamide;hydrochloride
CID 169490459

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide (CID 126473227) is N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide is COc1ccc2[nH]c3c(c2c1)CCOC31CCN(C(=O)Nc2ccc(C(C)=O)cc2)CC1.
What is the InChIKey of N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide?
The InChIKey is MEPYCAKFPWTAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27N3O4/c1-16(29)17-3-5-18(6-4-17)26-24(30)28-12-10-25(11-13-28)23-20(9-14-32-25)21-15-19(31-2)7-8-22(21)27-23/h3-8,15,27H,9-14H2,1-2H3,(H,26,30).
What are the key properties of N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide?
N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide has a molecular weight of 433.51 g/mol, XLogP of 4.47, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-6-methoxyspiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carboxamide is sourced from PubChem (CID 126473227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).