N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide

C23H30N2O2 — CID 91483085

IUPACN-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide
SMILESCCC(C(=O)NCCC(C)(C)C)n1c2ccccc2c2ccc(OC)cc21
InChIInChI=1S/C23H30N2O2/c1-6-19(22(26)24-14-13-23(2,3)4)25-20-10-8-7-9-17(20)18-12-11-16(27-5)15-21(18)25/h7-12,15,19H,6,13-14H2,1-5H3,(H,24,26)
InChIKeyYIDVTAMDTAPFND-UHFFFAOYSA-N
MW366.51 g/mol
LogP5.31
Rot. Bonds6

About N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide

N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide (PubChem CID 91483085) has the molecular formula C23H30N2O2 and a molecular weight of 366.51 g/mol. Its IUPAC name is N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide.

Molecular Properties

Compound NameN-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide
PubChem CID91483085
Molecular FormulaC23H30N2O2
Molecular Weight366.51 g/mol
Exact Mass366.23
IUPAC NameN-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide
SMILESCCC(C(=O)NCCC(C)(C)C)n1c2ccccc2c2ccc(OC)cc21
InChIInChI=1S/C23H30N2O2/c1-6-19(22(26)24-14-13-23(2,3)4)25-20-10-8-7-9-17(20)18-12-11-16(27-5)15-21(18)25/h7-12,15,19H,6,13-14H2,1-5H3,(H,24,26)
InChIKeyYIDVTAMDTAPFND-UHFFFAOYSA-N
XLogP5.31
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.51
LogP ≤ 55.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methoxyphenyl)-2-(4-methyl-2-oxoquinolin-1-yl)butanamide
CID 46301055
(2R)-N-[2-(3-methoxyphenyl)ethyl]-2-(3-methyl-4-oxopyridazino[4,5-b]indol-5-yl)butanamide
CID 95059132
tert-butyl 2-carbazol-9-ylbutanoate
CID 91602000
(2S)-N-[(4-methoxyphenyl)methyl]-2-(3-methyl-4-oxopyridazino[4,5-b]indol-5-yl)butanamide
CID 95059407
N-(3,3-dimethylbutyl)-N-ethyl-2-(2-methoxycarbazol-9-yl)acetamide
CID 11696301
2-(2-benzoyl-6-methoxybenzimidazol-1-yl)-N-tert-butylbutanamide
CID 90871410
1-(3,3-dimethylbutyl)-3-[(3-methoxyphenyl)methyl]urea
CID 38270007
N,N-dibutyl-2-(2-methoxycarbazol-9-yl)acetamide;9-(3,3-dimethylbutyl)-2-methoxycarbazole;2-(2-methoxycarbazol-9-yl)-N,N-bis(2-methylpropyl)acetamide
CID 143217110
2-(2-methoxycarbazol-9-yl)-2-propylhexanamide
CID 91573517
1-(3-methoxycarbazol-9-yl)pentan-1-one
CID 153297253
9-butyl-3-methoxycarbazole
CID 132503458
5-(3-methoxycarbazol-9-yl)pentan-1-ol
CID 153297193

Frequently Asked Questions

What is the IUPAC name of N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide?
The IUPAC name of N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide (CID 91483085) is N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide.
What is the SMILES notation for N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide?
The canonical SMILES for N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide is CCC(C(=O)NCCC(C)(C)C)n1c2ccccc2c2ccc(OC)cc21.
What is the InChIKey of N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide?
The InChIKey is YIDVTAMDTAPFND-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O2/c1-6-19(22(26)24-14-13-23(2,3)4)25-20-10-8-7-9-17(20)18-12-11-16(27-5)15-21(18)25/h7-12,15,19H,6,13-14H2,1-5H3,(H,24,26).
What are the key properties of N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide?
N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide has a molecular weight of 366.51 g/mol, XLogP of 5.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-dimethylbutyl)-2-(2-methoxycarbazol-9-yl)butanamide is sourced from PubChem (CID 91483085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).