N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide

C27H24N2O — CID 143214514

IUPACN,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide
SMILESCN(C)C(=O)c1ccccccc(-n2c(-c3ccccc3)cc3ccccc32)cc1
InChIInChI=1S/C27H24N2O/c1-28(2)27(30)22-14-6-3-4-9-16-24(19-18-22)29-25-17-11-10-15-23(25)20-26(29)21-12-7-5-8-13-21/h3-20H,1-2H3/b4-3+,6-3-,9-4+,14-6-,16-9-,19-18+,22-14+,22-18-,24-16+,24-19+
InChIKeyASTZVPRIYXRATE-ULQVXNRXSA-N
MW392.50 g/mol
LogP6.12
Rot. Bonds3

About N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide

N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide (PubChem CID 143214514) has the molecular formula C27H24N2O and a molecular weight of 392.50 g/mol. Its IUPAC name is N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide
PubChem CID143214514
Molecular FormulaC27H24N2O
Molecular Weight392.50 g/mol
Exact Mass392.19
IUPAC NameN,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide
SMILESCN(C)C(=O)c1ccccccc(-n2c(-c3ccccc3)cc3ccccc32)cc1
InChIInChI=1S/C27H24N2O/c1-28(2)27(30)22-14-6-3-4-9-16-24(19-18-22)29-25-17-11-10-15-23(25)20-26(29)21-12-7-5-8-13-21/h3-20H,1-2H3/b4-3+,6-3-,9-4+,14-6-,16-9-,19-18+,22-14+,22-18-,24-16+,24-19+
InChIKeyASTZVPRIYXRATE-ULQVXNRXSA-N
XLogP6.12
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500392.50
LogP ≤ 56.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-bis(4-methylphenyl)indole
CID 151814608
N-phenyl-N-[4-(2-phenylindol-1-yl)phenyl]-4-[4-(N-[4-(2-phenylindol-1-yl)phenyl]anilino)phenyl]aniline
CID 144768904
1-(3-methylphenyl)-2-phenylindole
CID 101372494
N,N-diphenyl-4-(1-phenylindol-2-yl)aniline
CID 59993805
1,2-diphenyl-6-[2-phenyl-1-(4-phenylphenyl)indol-6-yl]indole
CID 71230374
1-[4-[2-(2-methylphenyl)indol-1-yl]phenyl]ethanone
CID 59664118
3-(7-tert-butyl-2-phenylindol-1-yl)benzoic acid
CID 59214652
2-phenyl-1-pyridin-3-ylindole
CID 59214542
9-[4-[1-[3-(4,6-diphenylpyrimidin-2-yl)phenyl]indol-2-yl]phenyl]carbazole
CID 145105553
N-phenyl-N-[4-(1-phenylindol-2-yl)phenyl]naphthalen-1-amine
CID 145013973
1-phenyl-3-(2-phenylindol-1-yl)propan-1-one
CID 151018616
2-[4-[diphenyl-[4-(3-phenylnaphthalen-2-yl)phenyl]methyl]phenyl]-1-phenylindole
CID 142142857

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide (CID 143214514) is N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide is CN(C)C(=O)c1ccccccc(-n2c(-c3ccccc3)cc3ccccc32)cc1.
What is the InChIKey of N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide?
The InChIKey is ASTZVPRIYXRATE-ULQVXNRXSA-N. The full InChI is InChI=1S/C27H24N2O/c1-28(2)27(30)22-14-6-3-4-9-16-24(19-18-22)29-25-17-11-10-15-23(25)20-26(29)21-12-7-5-8-13-21/h3-20H,1-2H3/b4-3+,6-3-,9-4+,14-6-,16-9-,19-18+,22-14+,22-18-,24-16+,24-19+.
What are the key properties of N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide?
N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide has a molecular weight of 392.50 g/mol, XLogP of 6.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(2-phenylindol-1-yl)cyclodeca-1,3,5,7,9-pentaene-1-carboxamide is sourced from PubChem (CID 143214514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).