9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide

C19H20N2O — CID 174418330

IUPAC9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide
SMILESCCc1ccc2c3c(C(N)=O)cccc3n(CC3CC3)c2c1
InChIInChI=1S/C19H20N2O/c1-2-12-8-9-14-17(10-12)21(11-13-6-7-13)16-5-3-4-15(18(14)16)19(20)22/h3-5,8-10,13H,2,6-7,11H2,1H3,(H2,20,22)
InChIKeyLGYVKODJBPZTGQ-UHFFFAOYSA-N
MW292.38 g/mol
LogP3.87
Rot. Bonds4

About 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide

9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide (PubChem CID 174418330) has the molecular formula C19H20N2O and a molecular weight of 292.38 g/mol. Its IUPAC name is 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide.

Molecular Properties

Compound Name9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide
PubChem CID174418330
Molecular FormulaC19H20N2O
Molecular Weight292.38 g/mol
Exact Mass292.16
IUPAC Name9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide
SMILESCCc1ccc2c3c(C(N)=O)cccc3n(CC3CC3)c2c1
InChIInChI=1S/C19H20N2O/c1-2-12-8-9-14-17(10-12)21(11-13-6-7-13)16-5-3-4-15(18(14)16)19(20)22/h3-5,8-10,13H,2,6-7,11H2,1H3,(H2,20,22)
InChIKeyLGYVKODJBPZTGQ-UHFFFAOYSA-N
XLogP3.87
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide?
The IUPAC name of 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide (CID 174418330) is 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide.
What is the SMILES notation for 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide?
The canonical SMILES for 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide is CCc1ccc2c3c(C(N)=O)cccc3n(CC3CC3)c2c1.
What is the InChIKey of 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide?
The InChIKey is LGYVKODJBPZTGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O/c1-2-12-8-9-14-17(10-12)21(11-13-6-7-13)16-5-3-4-15(18(14)16)19(20)22/h3-5,8-10,13H,2,6-7,11H2,1H3,(H2,20,22).
What are the key properties of 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide?
9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide has a molecular weight of 292.38 g/mol, XLogP of 3.87, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(cyclopropylmethyl)-7-ethylcarbazole-4-carboxamide is sourced from PubChem (CID 174418330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).