N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine

C13H17FN2 — CID 174362793

IUPACN-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNC1=CC=C2C(F)=CC=C2C1
InChIInChI=1S/C13H17FN2/c1-16(2)8-7-15-11-4-5-12-10(9-11)3-6-13(12)14/h3-6,15H,7-9H2,1-2H3
InChIKeyDSBJMIUMZPIUQN-UHFFFAOYSA-N
MW220.29 g/mol
LogP2.14
Rot. Bonds4

About N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine

N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine (PubChem CID 174362793) has the molecular formula C13H17FN2 and a molecular weight of 220.29 g/mol. Its IUPAC name is N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine
PubChem CID174362793
Molecular FormulaC13H17FN2
Molecular Weight220.29 g/mol
Exact Mass220.14
IUPAC NameN-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNC1=CC=C2C(F)=CC=C2C1
InChIInChI=1S/C13H17FN2/c1-16(2)8-7-15-11-4-5-12-10(9-11)3-6-13(12)14/h3-6,15H,7-9H2,1-2H3
InChIKeyDSBJMIUMZPIUQN-UHFFFAOYSA-N
XLogP2.14
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.29
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine 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

1-(4-Fluorocyclohexa-1,5-dien-1-yl)-8-methyl-1,4-diazonane
CID 129260267
(3R)-2-(2-fluoro-2-methylpropyl)-1,3-dimethyl-1,3,4,6,7,9-hexahydropyrido[3,4-b]indole
CID 132036694
3-N-[(4-fluorocyclohexa-1,3-dien-1-yl)methyl]-3-N-methylbuta-1,3-diene-2,3-diamine
CID 135269419
N'-[1-(7-fluoro-5,6-dihydro-1H-indol-3-yl)ethenyl]-N-hexylpentane-1,5-diamine
CID 137414307
(1Z,3E)-1-[1-methyl-4-(trifluoromethyl)-6-[4-(trifluoromethyl)-1,2,3,6-tetrahydropyridin-2-yl]-2H-pyridin-2-yl]-3-(trifluoromethyl)penta-1,3-dien-1-amine
CID 138626042
6-(4-fluorocyclohexa-1,3-dien-1-yl)-2,3,3-trimethyl-2,4-dihydro-1H-pyrazine
CID 139525633
N'-(4-fluorocyclohexa-1,3-dien-1-yl)-N,N'-dimethylethane-1,2-diamine
CID 142349477
N,N'-dimethyl-N'-[3-(trifluoromethyl)cyclohexa-1,3-dien-1-yl]ethane-1,2-diamine
CID 143303397
1-N-[2-(dimethylamino)ethyl]-2-fluoro-1-N-methylcyclohexa-1,3-diene-1,4-diamine
CID 153631110
4-N-[2-(dimethylamino)ethyl]-2-fluoro-4-N-methylcyclohexa-1,3-diene-1,4-diamine
CID 153631397
(2E,5R)-6-(2-fluoro-2-methylpropyl)-5-methyl-2-[(2Z)-penta-2,4-dienylidene]-3,4,5,7-tetrahydro-1H-pyrrolo[2,3-c]pyridine
CID 154987694
(2Z,4Z)-9-(2-fluoro-2-methylpropyl)-6-methylidene-1,7,8,10-tetrahydropyrido[3,4-b]azocine
CID 154987711

Frequently Asked Questions

What is the IUPAC name of N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine (CID 174362793) is N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine is CN(C)CCNC1=CC=C2C(F)=CC=C2C1.
What is the InChIKey of N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine?
The InChIKey is DSBJMIUMZPIUQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17FN2/c1-16(2)8-7-15-11-4-5-12-10(9-11)3-6-13(12)14/h3-6,15H,7-9H2,1-2H3.
What are the key properties of N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine?
N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine has a molecular weight of 220.29 g/mol, XLogP of 2.14, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-fluoro-4H-inden-5-yl)-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 174362793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).