N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide

C24H24N4O3 — CID 174906730

IUPACN-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide
SMILESCc1noc(C)c1-c1cc(NC=O)c2[nH]c3cc(C(=O)N4CCCCC4)ccc3c2c1
InChIInChI=1S/C24H24N4O3/c1-14-22(15(2)31-27-14)17-10-19-18-7-6-16(24(30)28-8-4-3-5-9-28)11-20(18)26-23(19)21(12-17)25-13-29/h6-7,10-13,26H,3-5,8-9H2,1-2H3,(H,25,29)
InChIKeyLDUCJOKXTLQUGL-UHFFFAOYSA-N
MW416.48 g/mol
LogP4.79
Rot. Bonds4

About N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide

N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide (PubChem CID 174906730) has the molecular formula C24H24N4O3 and a molecular weight of 416.48 g/mol. Its IUPAC name is N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide.

Molecular Properties

Compound NameN-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide
PubChem CID174906730
Molecular FormulaC24H24N4O3
Molecular Weight416.48 g/mol
Exact Mass416.18
IUPAC NameN-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide
SMILESCc1noc(C)c1-c1cc(NC=O)c2[nH]c3cc(C(=O)N4CCCCC4)ccc3c2c1
InChIInChI=1S/C24H24N4O3/c1-14-22(15(2)31-27-14)17-10-19-18-7-6-16(24(30)28-8-4-3-5-9-28)11-20(18)26-23(19)21(12-17)25-13-29/h6-7,10-13,26H,3-5,8-9H2,1-2H3,(H,25,29)
InChIKeyLDUCJOKXTLQUGL-UHFFFAOYSA-N
XLogP4.79
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.48
LogP ≤ 54.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-2-yl]-morpholin-4-ylmethanone
CID 90375239
3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(morpholine-4-carbonyl)-9H-carbazole-1-carbothioamide
CID 90375232
1-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazole-2-carbonyl]piperidine-4-carbonitrile
CID 141418557
7-(2,6-dimethylmorpholine-4-carbonyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazole-1-carboxamide
CID 90376698
[(2R,6S)-2,6-dimethylmorpholin-4-yl]-[7-(3,5-dimethyl-1,2-oxazol-4-yl)-9H-carbazol-3-yl]methanone
CID 90376112
methyl 7-(3,5-dimethyl-1,2-oxazol-4-yl)-5H-pyrido[3,2-b]indole-3-carboxylate
CID 122688323
azocan-1-yl-(2,3-dimethylquinoxalin-6-yl)methanone
CID 47009187
[3-(4-methylphenyl)-2,1-benzoxazol-5-yl]-pyrrolidin-1-ylmethanone
CID 22575651
azane;[4-[2-(2,6-dimethyl-4-pyridinyl)-3-methyl-1H-indol-6-yl]phenyl]-pyrrolidin-1-ylmethanone
CID 164553752
2-(3,5-dimethyl-1,2-oxazol-4-yl)-6-(3-fluoroazetidine-1-carbonyl)-N-methyl-9H-carbazole-4-carboxamide
CID 90375974
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)phenyl]formamide
CID 173261261
3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(4-fluoropiperidine-1-carbonyl)-9-methylsulfonylcarbazole-1-carboxamide
CID 118644502

Frequently Asked Questions

What is the IUPAC name of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide?
The IUPAC name of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide (CID 174906730) is N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide.
What is the SMILES notation for N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide?
The canonical SMILES for N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide is Cc1noc(C)c1-c1cc(NC=O)c2[nH]c3cc(C(=O)N4CCCCC4)ccc3c2c1.
What is the InChIKey of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide?
The InChIKey is LDUCJOKXTLQUGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O3/c1-14-22(15(2)31-27-14)17-10-19-18-7-6-16(24(30)28-8-4-3-5-9-28)11-20(18)26-23(19)21(12-17)25-13-29/h6-7,10-13,26H,3-5,8-9H2,1-2H3,(H,25,29).
What are the key properties of N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide?
N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide has a molecular weight of 416.48 g/mol, XLogP of 4.79, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3,5-dimethyl-1,2-oxazol-4-yl)-7-(piperidine-1-carbonyl)-9H-carbazol-1-yl]formamide is sourced from PubChem (CID 174906730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).