1-(9-ethylcarbazol-3-yl)-N-methylmethanamine

C16H18N2 — CID 4722579

IUPAC1-(9-ethylcarbazol-3-yl)-N-methylmethanamine
SMILESCCn1c2ccccc2c2cc(CNC)ccc21
InChIInChI=1S/C16H18N2/c1-3-18-15-7-5-4-6-13(15)14-10-12(11-17-2)8-9-16(14)18/h4-10,17H,3,11H2,1-2H3
InChIKeyLBPNOEAFWYTTEB-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.53
Rot. Bonds3

About 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine

1-(9-ethylcarbazol-3-yl)-N-methylmethanamine (PubChem CID 4722579) has the molecular formula C16H18N2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(9-ethylcarbazol-3-yl)-N-methylmethanamine
PubChem CID4722579
Molecular FormulaC16H18N2
Molecular Weight238.33 g/mol
Exact Mass238.15
IUPAC Name1-(9-ethylcarbazol-3-yl)-N-methylmethanamine
SMILESCCn1c2ccccc2c2cc(CNC)ccc21
InChIInChI=1S/C16H18N2/c1-3-18-15-7-5-4-6-13(15)14-10-12(11-17-2)8-9-16(14)18/h4-10,17H,3,11H2,1-2H3
InChIKeyLBPNOEAFWYTTEB-UHFFFAOYSA-N
XLogP3.53
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine?
The IUPAC name of 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine (CID 4722579) is 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine?
The canonical SMILES for 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine is CCn1c2ccccc2c2cc(CNC)ccc21.
What is the InChIKey of 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine?
The InChIKey is LBPNOEAFWYTTEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2/c1-3-18-15-7-5-4-6-13(15)14-10-12(11-17-2)8-9-16(14)18/h4-10,17H,3,11H2,1-2H3.
What are the key properties of 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine?
1-(9-ethylcarbazol-3-yl)-N-methylmethanamine has a molecular weight of 238.33 g/mol, XLogP of 3.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9-ethylcarbazol-3-yl)-N-methylmethanamine is sourced from PubChem (CID 4722579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).