5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine

C23H26N4 — CID 55684008

IUPAC5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine
SMILESCCn1c2ccccc2c2cc(CNCc3ccc(N(C)C)nc3)ccc21
InChIInChI=1S/C23H26N4/c1-4-27-21-8-6-5-7-19(21)20-13-17(9-11-22(20)27)14-24-15-18-10-12-23(25-16-18)26(2)3/h5-13,16,24H,4,14-15H2,1-3H3
InChIKeyZOGPTPYCOXBVQF-UHFFFAOYSA-N
MW358.49 g/mol
LogP4.57
Rot. Bonds6

About 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine

5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine (PubChem CID 55684008) has the molecular formula C23H26N4 and a molecular weight of 358.49 g/mol. Its IUPAC name is 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine.

Molecular Properties

Compound Name5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine
PubChem CID55684008
Molecular FormulaC23H26N4
Molecular Weight358.49 g/mol
Exact Mass358.22
IUPAC Name5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine
SMILESCCn1c2ccccc2c2cc(CNCc3ccc(N(C)C)nc3)ccc21
InChIInChI=1S/C23H26N4/c1-4-27-21-8-6-5-7-19(21)20-13-17(9-11-22(20)27)14-24-15-18-10-12-23(25-16-18)26(2)3/h5-13,16,24H,4,14-15H2,1-3H3
InChIKeyZOGPTPYCOXBVQF-UHFFFAOYSA-N
XLogP4.57
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine?
The IUPAC name of 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine (CID 55684008) is 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine.
What is the SMILES notation for 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine?
The canonical SMILES for 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine is CCn1c2ccccc2c2cc(CNCc3ccc(N(C)C)nc3)ccc21.
What is the InChIKey of 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine?
The InChIKey is ZOGPTPYCOXBVQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4/c1-4-27-21-8-6-5-7-19(21)20-13-17(9-11-22(20)27)14-24-15-18-10-12-23(25-16-18)26(2)3/h5-13,16,24H,4,14-15H2,1-3H3.
What are the key properties of 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine?
5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine has a molecular weight of 358.49 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[(9-ethylcarbazol-3-yl)methylamino]methyl]-N,N-dimethylpyridin-2-amine is sourced from PubChem (CID 55684008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).