7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine

C15H23N — CID 84622702

IUPAC7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
SMILESCCc1ccc2c(c1)C(NC)CC(C)(C)C2
InChIInChI=1S/C15H23N/c1-5-11-6-7-12-9-15(2,3)10-14(16-4)13(12)8-11/h6-8,14,16H,5,9-10H2,1-4H3
InChIKeyKWGLMCCTDWSAHR-UHFFFAOYSA-N
MW217.36 g/mol
LogP3.48
Rot. Bonds2

About 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine

7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine (PubChem CID 84622702) has the molecular formula C15H23N and a molecular weight of 217.36 g/mol. Its IUPAC name is 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine.

Molecular Properties

Compound Name7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
PubChem CID84622702
Molecular FormulaC15H23N
Molecular Weight217.36 g/mol
Exact Mass217.18
IUPAC Name7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
SMILESCCc1ccc2c(c1)C(NC)CC(C)(C)C2
InChIInChI=1S/C15H23N/c1-5-11-6-7-12-9-15(2,3)10-14(16-4)13(12)8-11/h6-8,14,16H,5,9-10H2,1-4H3
InChIKeyKWGLMCCTDWSAHR-UHFFFAOYSA-N
XLogP3.48
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
CID 84618813
3-bromo-N,7,7-trimethyl-5,6,8,9-tetrahydrobenzo[7]annulen-5-amine
CID 62934035
N-butyl-3,3,7-trimethyl-2,4-dihydro-1H-naphthalen-1-amine
CID 156754055
6-butyl-N,2,2-trimethyl-3,4-dihydrochromen-4-amine
CID 115492942
N,6-diethyl-3,4-dihydro-1H-isothiochromen-4-amine
CID 82887492
3-ethyl-N-propyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 63512839
7-ethyl-3,3-dimethyl-2,4-dihydro-1H-isoquinoline
CID 82125519
(4S)-6-ethyl-2,2-dimethyl-3,4-dihydrochromen-4-amine
CID 42220642
2-amino-7-ethyl-4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-ol
CID 84623396
2-[8-(methylamino)-5,6,7,8-tetrahydronaphthalen-2-yl]ethanol
CID 140546210
ethane;6-ethyl-3,3-dimethyl-2,4-dihydronaphthalen-1-one
CID 145183093
(1S,8R)-4-ethyltricyclo[6.2.1.02,7]undeca-2(7),3,5-triene
CID 10797293

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine?
The IUPAC name of 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine (CID 84622702) is 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine.
What is the SMILES notation for 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine?
The canonical SMILES for 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine is CCc1ccc2c(c1)C(NC)CC(C)(C)C2.
What is the InChIKey of 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine?
The InChIKey is KWGLMCCTDWSAHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N/c1-5-11-6-7-12-9-15(2,3)10-14(16-4)13(12)8-11/h6-8,14,16H,5,9-10H2,1-4H3.
What are the key properties of 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine?
7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine has a molecular weight of 217.36 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-N,3,3-trimethyl-2,4-dihydro-1H-naphthalen-1-amine is sourced from PubChem (CID 84622702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).