N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

C23H25N3O3 — CID 134000227

IUPACN-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESO=C(NC1CCN(C(=O)c2ccco2)CC1)c1ccc2[nH]c3c(c2c1)CCCC3
InChIInChI=1S/C23H25N3O3/c27-22(15-7-8-20-18(14-15)17-4-1-2-5-19(17)25-20)24-16-9-11-26(12-10-16)23(28)21-6-3-13-29-21/h3,6-8,13-14,16,25H,1-2,4-5,9-12H2,(H,24,27)
InChIKeySQZCDCGULYLTFL-UHFFFAOYSA-N
MW391.47 g/mol
LogP3.67
Rot. Bonds3

About N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (PubChem CID 134000227) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.

Molecular Properties

Compound NameN-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
PubChem CID134000227
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESO=C(NC1CCN(C(=O)c2ccco2)CC1)c1ccc2[nH]c3c(c2c1)CCCC3
InChIInChI=1S/C23H25N3O3/c27-22(15-7-8-20-18(14-15)17-4-1-2-5-19(17)25-20)24-16-9-11-26(12-10-16)23(28)21-6-3-13-29-21/h3,6-8,13-14,16,25H,1-2,4-5,9-12H2,(H,24,27)
InChIKeySQZCDCGULYLTFL-UHFFFAOYSA-N
XLogP3.67
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

2-(furan-2-carbonyl)-1,3,4,5-tetrahydropyrido[4,3-b]indole-8-carboxylic acid
CID 113081820
N-(1-pyrimidin-2-ylpiperidin-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 55721169
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 16613592
N-[1-(furan-2-carbonyl)piperidin-4-yl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
CID 18149413
3-benzamido-N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-methylbenzamide
CID 55634715
N-[(Z)-furan-2-ylmethylideneamino]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 112538210
N-[1-(furan-2-carbonyl)piperidin-4-yl]-3,5-dinitrobenzamide
CID 134000280
4,5-dichloro-N-[1-(furan-2-carbonyl)piperidin-4-yl]-1H-pyrrole-2-carboxamide
CID 78836748
N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 32687068
N-[1-[4-(dimethylamino)benzoyl]piperidin-4-yl]furan-2-carboxamide
CID 110821547
5-fluoro-N-[1-(furan-2-carbonyl)piperidin-4-yl]pyridine-3-carboxamide
CID 136514589
N-[1-(furan-2-carbonyl)piperidin-4-yl]-5-methyl-1H-indazole-3-carboxamide
CID 78868846

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The IUPAC name of N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (CID 134000227) is N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.
What is the SMILES notation for N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The canonical SMILES for N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is O=C(NC1CCN(C(=O)c2ccco2)CC1)c1ccc2[nH]c3c(c2c1)CCCC3.
What is the InChIKey of N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The InChIKey is SQZCDCGULYLTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c27-22(15-7-8-20-18(14-15)17-4-1-2-5-19(17)25-20)24-16-9-11-26(12-10-16)23(28)21-6-3-13-29-21/h3,6-8,13-14,16,25H,1-2,4-5,9-12H2,(H,24,27).
What are the key properties of N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide has a molecular weight of 391.47 g/mol, XLogP of 3.67, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-carbonyl)piperidin-4-yl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is sourced from PubChem (CID 134000227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).