7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde

C19H26N2O — CID 19041549

IUPAC7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde
SMILESCCCN(CCC)C1CCc2c(ccc3c(C=O)c[nH]c23)C1
InChIInChI=1S/C19H26N2O/c1-3-9-21(10-4-2)16-6-8-17-14(11-16)5-7-18-15(13-22)12-20-19(17)18/h5,7,12-13,16,20H,3-4,6,8-11H2,1-2H3
InChIKeyCZSNLSBTKWNIOK-UHFFFAOYSA-N
MW298.43 g/mol
LogP3.96
Rot. Bonds6

About 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde

7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde (PubChem CID 19041549) has the molecular formula C19H26N2O and a molecular weight of 298.43 g/mol. Its IUPAC name is 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde.

Molecular Properties

Compound Name7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde
PubChem CID19041549
Molecular FormulaC19H26N2O
Molecular Weight298.43 g/mol
Exact Mass298.20
IUPAC Name7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde
SMILESCCCN(CCC)C1CCc2c(ccc3c(C=O)c[nH]c23)C1
InChIInChI=1S/C19H26N2O/c1-3-9-21(10-4-2)16-6-8-17-14(11-16)5-7-18-15(13-22)12-20-19(17)18/h5,7,12-13,16,20H,3-4,6,8-11H2,1-2H3
InChIKeyCZSNLSBTKWNIOK-UHFFFAOYSA-N
XLogP3.96
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.43
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N,N-dipropyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-7-amine
CID 13342884
7-(dipropylamino)-5,6,7,8-tetrahydronaphthalene-1-carbaldehyde
CID 15230497
1-[7-(dipropylamino)-6,7,8,9-tetrahydro-3H-benzo[e]indol-1-yl]ethanone
CID 19041535
(4R)-4-(dipropylamino)-1,3,4,5-tetrahydrobenzo[cd]indole-6-carbaldehyde
CID 10613080
N-(cyclobutylmethyl)-N-propyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-7-amine
CID 19041512
(6R)-6-N,6-N-dipropyl-5,6,7,8-tetrahydronaphthalene-1,6-diamine;dihydrochloride
CID 18650733
N-prop-2-enyl-N-propyl-6,7,8,9-tetrahydro-3H-benzo[e]indol-8-amine
CID 10378357
6-methoxy-5-nitro-N,N-dipropyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 13186869
(6S)-6-[7-[[(2S)-5-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]-propylamino]heptyl-propylamino]-5,6,7,8-tetrahydronaphthalen-1-ol
CID 71459664
2-(dipropylamino)-2,3-dihydro-1H-indene-5-carbaldehyde
CID 19710217
6-N-ethyl-6-N-propyl-5,6,7,8-tetrahydronaphthalene-1,6-diamine
CID 14836516
(6S)-6-[2-butoxyethyl(propyl)amino]-5,6,7,8-tetrahydronaphthalene-1,2-diol
CID 15228242

Frequently Asked Questions

What is the IUPAC name of 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde?
The IUPAC name of 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde (CID 19041549) is 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde.
What is the SMILES notation for 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde?
The canonical SMILES for 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde is CCCN(CCC)C1CCc2c(ccc3c(C=O)c[nH]c23)C1.
What is the InChIKey of 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde?
The InChIKey is CZSNLSBTKWNIOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O/c1-3-9-21(10-4-2)16-6-8-17-14(11-16)5-7-18-15(13-22)12-20-19(17)18/h5,7,12-13,16,20H,3-4,6,8-11H2,1-2H3.
What are the key properties of 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde?
7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde has a molecular weight of 298.43 g/mol, XLogP of 3.96, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(dipropylamino)-6,7,8,9-tetrahydro-1H-benzo[g]indole-3-carbaldehyde is sourced from PubChem (CID 19041549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).