N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine

C18H17N3 — CID 60943397

IUPACN-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine
SMILESc1ccc2c(c1)CCC(Nc1ccc3nccnc3c1)C2
InChIInChI=1S/C18H17N3/c1-2-4-14-11-15(6-5-13(14)3-1)21-16-7-8-17-18(12-16)20-10-9-19-17/h1-4,7-10,12,15,21H,5-6,11H2
InChIKeyXRMRZWBDHUMUNZ-UHFFFAOYSA-N
MW275.36 g/mol
LogP3.60
Rot. Bonds2

About N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine

N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine (PubChem CID 60943397) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine
PubChem CID60943397
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC NameN-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine
SMILESc1ccc2c(c1)CCC(Nc1ccc3nccnc3c1)C2
InChIInChI=1S/C18H17N3/c1-2-4-14-11-15(6-5-13(14)3-1)21-16-7-8-17-18(12-16)20-10-9-19-17/h1-4,7-10,12,15,21H,5-6,11H2
InChIKeyXRMRZWBDHUMUNZ-UHFFFAOYSA-N
XLogP3.60
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]pyridin-2-amine
CID 94392451
4-N-quinoxalin-6-ylcyclohexane-1,4-diamine
CID 79731132
N-(3,5-dichloro-4-fluorophenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 107572538
N-methyl-4-(1,2,3,4-tetrahydronaphthalen-2-ylamino)pyridine-2-carboxamide
CID 60704921
N-(4-methylsulfanylphenyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43759178
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1H-indol-5-amine
CID 43768671
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinolin-5-amine
CID 43759315
N-(1,2,3,4-tetrahydronaphthalen-2-yl)-1-benzothiophen-5-amine
CID 43781963
2-amino-5-(1,2,3,4-tetrahydronaphthalen-2-ylamino)benzoic acid
CID 62317637
2-chloro-1-N,1-N-dimethyl-4-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzene-1,4-diamine
CID 63450820
methyl 3-(1,2,3,4-tetrahydronaphthalen-2-ylamino)benzoate
CID 43774418
2-fluoro-5-(1,2,3,4-tetrahydronaphthalen-2-ylamino)benzamide
CID 43783999

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine?
The IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine (CID 60943397) is N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine.
What is the SMILES notation for N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine?
The canonical SMILES for N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine is c1ccc2c(c1)CCC(Nc1ccc3nccnc3c1)C2.
What is the InChIKey of N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine?
The InChIKey is XRMRZWBDHUMUNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-2-4-14-11-15(6-5-13(14)3-1)21-16-7-8-17-18(12-16)20-10-9-19-17/h1-4,7-10,12,15,21H,5-6,11H2.
What are the key properties of N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine?
N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine has a molecular weight of 275.36 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydronaphthalen-2-yl)quinoxalin-6-amine is sourced from PubChem (CID 60943397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).