N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine

C17H22N2 — CID 140994193

IUPACN,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine
SMILESCCCN(CCC)C1C=c2cc3c(cc2C1)=CN=C3
InChIInChI=1S/C17H22N2/c1-3-5-19(6-4-2)17-9-13-7-15-11-18-12-16(15)8-14(13)10-17/h7-9,11-12,17H,3-6,10H2,1-2H3
InChIKeyJQCKJURHOMSKDD-UHFFFAOYSA-N
MW254.38 g/mol
LogP1.68
Rot. Bonds5

About N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine

N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine (PubChem CID 140994193) has the molecular formula C17H22N2 and a molecular weight of 254.38 g/mol. Its IUPAC name is N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine.

Molecular Properties

Compound NameN,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine
PubChem CID140994193
Molecular FormulaC17H22N2
Molecular Weight254.38 g/mol
Exact Mass254.18
IUPAC NameN,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine
SMILESCCCN(CCC)C1C=c2cc3c(cc2C1)=CN=C3
InChIInChI=1S/C17H22N2/c1-3-5-19(6-4-2)17-9-13-7-15-11-18-12-16(15)8-14(13)10-17/h7-9,11-12,17H,3-6,10H2,1-2H3
InChIKeyJQCKJURHOMSKDD-UHFFFAOYSA-N
XLogP1.68
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.38
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[[(2R)-2-methylpyrrolidin-1-yl]methylidene]-4,5,6,7-tetrahydroindole
CID 155936115
3-methyl-N,N-dipropyl-6,7,8,8a-tetrahydroquinolin-7-amine
CID 57074375
5-[(2S)-1-methylpyrrolidin-2-yl]-2,3-dihydropyridine
CID 89056573
N,N-dipropylcyclopenta[f]isoindol-6-amine
CID 140994204
(E)-N-ethenyl-3-[(3E)-1-ethyl-4-methylidene-3-prop-2-enylidenepiperidin-2-yl]prop-2-en-1-imine
CID 143866486
(2Z)-N-methyl-2-(1-methylpyrrolidin-2-yl)penta-2,4-dien-1-imine
CID 144108460
N,N-dimethyl-2-(5-methyl-4H-indol-3-yl)ethanamine
CID 163386256
N-methyl-1-[1-propan-2-yl-6-[(Z)-prop-1-enyl]-3,4-dihydro-2H-pyridin-5-yl]methanimine
CID 169649334
(Z)-N-[[4-(methyliminomethyl)cyclopenta-1,3-dien-1-yl]methyl]-N-prop-1-en-2-ylprop-1-en-1-amine
CID 169987187
5-(1-Methylpyrrolidin-2-yl)-2,3-dihydropyridine
CID 174192908
N-[(E)-4-imino-3-methylbut-2-en-2-yl]-N,3-dimethyl-1-(2-methylcyclohexa-1,3-dien-1-yl)but-2-en-1-amine
CID 143440452
3-cyclopenta-2,4-dien-1-ylidene-4-[(2R,5R)-2,5-dimethylpyrrolidin-1-yl]-4H-pyridine
CID 156023895

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine?
The IUPAC name of N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine (CID 140994193) is N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine.
What is the SMILES notation for N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine?
The canonical SMILES for N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine is CCCN(CCC)C1C=c2cc3c(cc2C1)=CN=C3.
What is the InChIKey of N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine?
The InChIKey is JQCKJURHOMSKDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2/c1-3-5-19(6-4-2)17-9-13-7-15-11-18-12-16(15)8-14(13)10-17/h7-9,11-12,17H,3-6,10H2,1-2H3.
What are the key properties of N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine?
N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine has a molecular weight of 254.38 g/mol, XLogP of 1.68, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine is sourced from PubChem (CID 140994193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).