N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

C24H24N4O — CID 71926269

IUPACN-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESO=C(NCc1nccn1Cc1ccccc1)c1ccc2[nH]c3c(c2c1)CCCC3
InChIInChI=1S/C24H24N4O/c29-24(18-10-11-22-20(14-18)19-8-4-5-9-21(19)27-22)26-15-23-25-12-13-28(23)16-17-6-2-1-3-7-17/h1-3,6-7,10-14,27H,4-5,8-9,15-16H2,(H,26,29)
InChIKeyWUAUCYZKURONSA-UHFFFAOYSA-N
MW384.48 g/mol
LogP4.22
Rot. Bonds5

About N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide

N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (PubChem CID 71926269) has the molecular formula C24H24N4O and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.

Molecular Properties

Compound NameN-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
PubChem CID71926269
Molecular FormulaC24H24N4O
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
SMILESO=C(NCc1nccn1Cc1ccccc1)c1ccc2[nH]c3c(c2c1)CCCC3
InChIInChI=1S/C24H24N4O/c29-24(18-10-11-22-20(14-18)19-8-4-5-9-21(19)27-22)26-15-23-25-12-13-28(23)16-17-6-2-1-3-7-17/h1-3,6-7,10-14,27H,4-5,8-9,15-16H2,(H,26,29)
InChIKeyWUAUCYZKURONSA-UHFFFAOYSA-N
XLogP4.22
TPSA62.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.22
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

N-[2-(1-benzylimidazol-2-yl)ethyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 134039749
3,4-difluoro-N-(6,7,8,9-tetrahydro-5H-carbazol-3-ylmethyl)benzamide
CID 3428305
N-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-ylmethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 51185250
N-prop-2-ynyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 18109932
[2-(benzylamino)-2-oxoethyl] 6,7,8,9-tetrahydro-5H-carbazole-3-carboxylate
CID 55321421
N-[(1,3-diaminoisoquinolin-7-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 172622961
N-(1-pyrimidin-2-ylpiperidin-4-yl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 55721169
N-[2-(1H-1,2,4-triazol-5-yl)ethyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 71929435
N-(3-piperidin-1-ylpropyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 35377516
N-(2-morpholin-4-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 24641089
N-(2-pyrrolidin-1-ylbutyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 43064788
ethane;molecular hydrogen;N-(2-piperidin-1-ylethyl)-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 156841300

Frequently Asked Questions

What is the IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The IUPAC name of N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide (CID 71926269) is N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide.
What is the SMILES notation for N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The canonical SMILES for N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is O=C(NCc1nccn1Cc1ccccc1)c1ccc2[nH]c3c(c2c1)CCCC3.
What is the InChIKey of N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
The InChIKey is WUAUCYZKURONSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N4O/c29-24(18-10-11-22-20(14-18)19-8-4-5-9-21(19)27-22)26-15-23-25-12-13-28(23)16-17-6-2-1-3-7-17/h1-3,6-7,10-14,27H,4-5,8-9,15-16H2,(H,26,29).
What are the key properties of N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide?
N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide has a molecular weight of 384.48 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-benzylimidazol-2-yl)methyl]-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide is sourced from PubChem (CID 71926269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).