9-ethyl-4a,9a-dihydrocarbazol-3-amine

C14H16N2 — CID 58886987

IUPAC9-ethyl-4a,9a-dihydrocarbazol-3-amine
SMILESCCN1c2ccccc2C2C=C(N)C=CC21
InChIInChI=1S/C14H16N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9,12,14H,2,15H2,1H3
InChIKeyILNKTAQKKBHWLL-UHFFFAOYSA-N
MW212.30 g/mol
LogP2.39
Rot. Bonds1

About 9-ethyl-4a,9a-dihydrocarbazol-3-amine

9-ethyl-4a,9a-dihydrocarbazol-3-amine (PubChem CID 58886987) has the molecular formula C14H16N2 and a molecular weight of 212.30 g/mol. Its IUPAC name is 9-ethyl-4a,9a-dihydrocarbazol-3-amine.

Molecular Properties

Compound Name9-ethyl-4a,9a-dihydrocarbazol-3-amine
PubChem CID58886987
Molecular FormulaC14H16N2
Molecular Weight212.30 g/mol
Exact Mass212.13
IUPAC Name9-ethyl-4a,9a-dihydrocarbazol-3-amine
SMILESCCN1c2ccccc2C2C=C(N)C=CC21
InChIInChI=1S/C14H16N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9,12,14H,2,15H2,1H3
InChIKeyILNKTAQKKBHWLL-UHFFFAOYSA-N
XLogP2.39
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.30
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-ethyl-4a,9a-dihydrocarbazol-3-amine?
The IUPAC name of 9-ethyl-4a,9a-dihydrocarbazol-3-amine (CID 58886987) is 9-ethyl-4a,9a-dihydrocarbazol-3-amine.
What is the SMILES notation for 9-ethyl-4a,9a-dihydrocarbazol-3-amine?
The canonical SMILES for 9-ethyl-4a,9a-dihydrocarbazol-3-amine is CCN1c2ccccc2C2C=C(N)C=CC21.
What is the InChIKey of 9-ethyl-4a,9a-dihydrocarbazol-3-amine?
The InChIKey is ILNKTAQKKBHWLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2/c1-2-16-13-6-4-3-5-11(13)12-9-10(15)7-8-14(12)16/h3-9,12,14H,2,15H2,1H3.
What are the key properties of 9-ethyl-4a,9a-dihydrocarbazol-3-amine?
9-ethyl-4a,9a-dihydrocarbazol-3-amine has a molecular weight of 212.30 g/mol, XLogP of 2.39, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-4a,9a-dihydrocarbazol-3-amine is sourced from PubChem (CID 58886987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).