N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide

C19H24N2O2 — CID 10543144

IUPACN-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide
SMILESCOc1ccc2c(c1)c1c(n2C)CCCC1CNC(=O)C1CC1
InChIInChI=1S/C19H24N2O2/c1-21-16-9-8-14(23-2)10-15(16)18-13(4-3-5-17(18)21)11-20-19(22)12-6-7-12/h8-10,12-13H,3-7,11H2,1-2H3,(H,20,22)
InChIKeyPEWOCDAZZFLSOZ-UHFFFAOYSA-N
MW312.41 g/mol
LogP3.13
Rot. Bonds4

About N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide

N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide (PubChem CID 10543144) has the molecular formula C19H24N2O2 and a molecular weight of 312.41 g/mol. Its IUPAC name is N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide
PubChem CID10543144
Molecular FormulaC19H24N2O2
Molecular Weight312.41 g/mol
Exact Mass312.18
IUPAC NameN-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide
SMILESCOc1ccc2c(c1)c1c(n2C)CCCC1CNC(=O)C1CC1
InChIInChI=1S/C19H24N2O2/c1-21-16-9-8-14(23-2)10-15(16)18-13(4-3-5-17(18)21)11-20-19(22)12-6-7-12/h8-10,12-13H,3-7,11H2,1-2H3,(H,20,22)
InChIKeyPEWOCDAZZFLSOZ-UHFFFAOYSA-N
XLogP3.13
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 53.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide?
The IUPAC name of N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide (CID 10543144) is N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide is COc1ccc2c(c1)c1c(n2C)CCCC1CNC(=O)C1CC1.
What is the InChIKey of N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide?
The InChIKey is PEWOCDAZZFLSOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O2/c1-21-16-9-8-14(23-2)10-15(16)18-13(4-3-5-17(18)21)11-20-19(22)12-6-7-12/h8-10,12-13H,3-7,11H2,1-2H3,(H,20,22).
What are the key properties of N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide?
N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide has a molecular weight of 312.41 g/mol, XLogP of 3.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-methoxy-9-methyl-1,2,3,4-tetrahydrocarbazol-4-yl)methyl]cyclopropanecarboxamide is sourced from PubChem (CID 10543144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).