N,N-dipropylcyclopenta[f]isoindol-6-amine

C17H20N2 — CID 140994204

IUPACN,N-dipropylcyclopenta[f]isoindol-6-amine
SMILESCCCN(CCC)C1=Cc2cc3c(cc2=C1)C=NC=3
InChIInChI=1S/C17H20N2/c1-3-5-19(6-4-2)17-9-13-7-15-11-18-12-16(15)8-14(13)10-17/h7-12H,3-6H2,1-2H3
InChIKeyVIWIQRFSCNUENP-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.11
Rot. Bonds5

About N,N-dipropylcyclopenta[f]isoindol-6-amine

N,N-dipropylcyclopenta[f]isoindol-6-amine (PubChem CID 140994204) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is N,N-dipropylcyclopenta[f]isoindol-6-amine.

Molecular Properties

Compound NameN,N-dipropylcyclopenta[f]isoindol-6-amine
PubChem CID140994204
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC NameN,N-dipropylcyclopenta[f]isoindol-6-amine
SMILESCCCN(CCC)C1=Cc2cc3c(cc2=C1)C=NC=3
InChIInChI=1S/C17H20N2/c1-3-5-19(6-4-2)17-9-13-7-15-11-18-12-16(15)8-14(13)10-17/h7-12H,3-6H2,1-2H3
InChIKeyVIWIQRFSCNUENP-UHFFFAOYSA-N
XLogP2.11
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methylpyrrolo[3,4-h]quinoline
CID 129781803
N-ethylpyrroloindole
CID 129873132
Pyrrolo[3,4-a]indolizine
CID 129876693
Pyrrolo-[3',4':3,4]pyrrolo[2,1-a]isoquinoline
CID 129876726
1,2-Dimethyl-5,7a-dihydropyrrolo[2,3-c]pyridine
CID 54026924
6-methyl-7H-pyrrolo[3,2-e]indole
CID 54483609
12-Methyl-3,9,12-triazatricyclo[6.6.1.04,15]pentadeca-1(15),2,4,6,8,10-hexaene
CID 57306056
1-methyl-2-[3-(1-methyl-2H-pyrrol-1-ium-3-yl)prop-2-enylidene]-4-[2-(1-methyl-2H-pyrrol-3-ylidene)ethylidene]pyrrolidine
CID 59085247
7,10-Diazatetracyclo[8.7.1.05,18.011,17]octadeca-1(17),2,5(18),6,8,11,13,15-octaene
CID 87871492
(3Z)-3-ethenyl-N,4-dimethyl-6-(methyliminomethyl)-N-propan-2-ylhepta-1,3,6-trien-2-amine
CID 132223438
(1E,3E)-8-[(2E)-1-ethyl-3-methylidene-2-prop-2-enylidenepyridin-1-ium-4-yl]-N,N-dimethylocta-1,3,5,7-tetraen-1-amine
CID 136621642
N,N-dipropyl-5,6-dihydrocyclopenta[f]isoindol-6-amine
CID 140994193

Frequently Asked Questions

What is the IUPAC name of N,N-dipropylcyclopenta[f]isoindol-6-amine?
The IUPAC name of N,N-dipropylcyclopenta[f]isoindol-6-amine (CID 140994204) is N,N-dipropylcyclopenta[f]isoindol-6-amine.
What is the SMILES notation for N,N-dipropylcyclopenta[f]isoindol-6-amine?
The canonical SMILES for N,N-dipropylcyclopenta[f]isoindol-6-amine is CCCN(CCC)C1=Cc2cc3c(cc2=C1)C=NC=3.
What is the InChIKey of N,N-dipropylcyclopenta[f]isoindol-6-amine?
The InChIKey is VIWIQRFSCNUENP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-3-5-19(6-4-2)17-9-13-7-15-11-18-12-16(15)8-14(13)10-17/h7-12H,3-6H2,1-2H3.
What are the key properties of N,N-dipropylcyclopenta[f]isoindol-6-amine?
N,N-dipropylcyclopenta[f]isoindol-6-amine has a molecular weight of 252.36 g/mol, XLogP of 2.11, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropylcyclopenta[f]isoindol-6-amine is sourced from PubChem (CID 140994204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).