1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine

C16H20N2O — CID 19036433

IUPAC1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine
SMILESCOc1ccc2c(c1)-c1c(ccn1CC(C)N)CC2
InChIInChI=1S/C16H20N2O/c1-11(17)10-18-8-7-13-4-3-12-5-6-14(19-2)9-15(12)16(13)18/h5-9,11H,3-4,10,17H2,1-2H3
InChIKeyWEVMVHGDQZICTG-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.61
Rot. Bonds3

About 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine

1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine (PubChem CID 19036433) has the molecular formula C16H20N2O and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine.

Molecular Properties

Compound Name1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine
PubChem CID19036433
Molecular FormulaC16H20N2O
Molecular Weight256.35 g/mol
Exact Mass256.16
IUPAC Name1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine
SMILESCOc1ccc2c(c1)-c1c(ccn1CC(C)N)CC2
InChIInChI=1S/C16H20N2O/c1-11(17)10-18-8-7-13-4-3-12-5-6-14(19-2)9-15(12)16(13)18/h5-9,11H,3-4,10,17H2,1-2H3
InChIKeyWEVMVHGDQZICTG-UHFFFAOYSA-N
XLogP2.61
TPSA40.18 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3Z)-5-methoxy-3-(6-methoxy-2,3-dihydroinden-1-ylidene)-1,2-dihydroindene
CID 125266195
N-[2-(7-methoxy-4,5-dihydrobenzo[g]indol-1-yl)ethyl]acetamide
CID 19036463
10-methoxy-1-(2-methylpropyl)-3,4,6,7-tetrahydro-2H-benzo[i][1,4]benzodiazepin-5-one
CID 512467
ethane;5-methoxytricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaen-2-one
CID 90841573
2-(7-methoxy-1-methyl-3,4-dihydronaphthalen-2-yl)acetic acid
CID 19048915
1-(7-methoxy-4,5-dihydrobenzo[e][1,3]benzothiazol-2-yl)propan-2-amine
CID 62652486
8-methoxy-2-methyl-4,5-dihydrobenzo[g]indazole
CID 118404764
4-(7-methoxy-2-methyl-3,4-dihydro-1H-isoquinolin-1-yl)butan-2-amine
CID 116995755
1-[(2E)-2-(6-methoxy-2,3-dihydroinden-1-ylidene)ethyl]pyrrolidine
CID 176832104
(2S)-3-(7-methoxy-3,4-dihydronaphthalen-2-yl)propane-1,2-diamine
CID 129386115
1-butan-2-yl-6-methoxy-2,3-dihydroindole
CID 134369277
2-[(6-methoxy-2,3-dihydroinden-1-ylidene)amino]guanidine
CID 79368772

Frequently Asked Questions

What is the IUPAC name of 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine?
The IUPAC name of 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine (CID 19036433) is 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine.
What is the SMILES notation for 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine?
The canonical SMILES for 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine is COc1ccc2c(c1)-c1c(ccn1CC(C)N)CC2.
What is the InChIKey of 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine?
The InChIKey is WEVMVHGDQZICTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O/c1-11(17)10-18-8-7-13-4-3-12-5-6-14(19-2)9-15(12)16(13)18/h5-9,11H,3-4,10,17H2,1-2H3.
What are the key properties of 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine?
1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine has a molecular weight of 256.35 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-methoxy-4,5-dihydrobenzo[g]indol-1-yl)propan-2-amine is sourced from PubChem (CID 19036433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).