N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine

C91H92F2N20 — CID 159753661

IUPACN-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine
SMILESCCCN(c1ccncc1)n1ccc2ccccc21.CCCN(c1ccncc1F)n1cc(C)c2ccccc21.CCCN(c1ccncc1N)n1cc(C)c2ccccc21.Cc1cn(Nc2ccncc2F)c2ccccc12.Cc1cn(Nc2ccncc2N)c2ccccc12.c1ccc2c(c1)ccn2Nc1ccncc1
InChIInChI=1S/C17H18FN3.C17H20N4.C16H17N3.C14H12FN3.C14H14N4.C13H11N3/c2*1-3-10-20(17-8-9-19-11-15(17)18)21-12-13(2)14-6-4-5-7-16(14)21;1-2-12-18(15-7-10-17-11-8-15)19-13-9-14-5-3-4-6-16(14)19;2*1-10-9-18(14-5-3-2-4-11(10)14)17-13-6-7-16-8-12(13)15;1-2-4-13-11(3-1)7-10-16(13)15-12-5-8-14-9-6-12/h4-9,11-12H,3,10H2,1-2H3;4-9,11-12H,3,10,18H2,1-2H3;3-11,13H,2,12H2,1H3;2-9H,1H3,(H,16,17);2-9H,15H2,1H3,(H,16,17);1-10H,(H,14,15)
InChIKeyNDYZUXFUWYRHMR-UHFFFAOYSA-N
MW1503.87 g/mol
LogP20.56
Rot. Bonds18

About N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine

N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine (PubChem CID 159753661) has the molecular formula C91H92F2N20 and a molecular weight of 1503.87 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine.

Molecular Properties

Compound NameN-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine
PubChem CID159753661
Molecular FormulaC91H92F2N20
Molecular Weight1503.87 g/mol
Exact Mass1502.78
IUPAC NameN-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine
SMILESCCCN(c1ccncc1)n1ccc2ccccc21.CCCN(c1ccncc1F)n1cc(C)c2ccccc21.CCCN(c1ccncc1N)n1cc(C)c2ccccc21.Cc1cn(Nc2ccncc2F)c2ccccc12.Cc1cn(Nc2ccncc2N)c2ccccc12.c1ccc2c(c1)ccn2Nc1ccncc1
InChIInChI=1S/C17H18FN3.C17H20N4.C16H17N3.C14H12FN3.C14H14N4.C13H11N3/c2*1-3-10-20(17-8-9-19-11-15(17)18)21-12-13(2)14-6-4-5-7-16(14)21;1-2-12-18(15-7-10-17-11-8-15)19-13-9-14-5-3-4-6-16(14)19;2*1-10-9-18(14-5-3-2-4-11(10)14)17-13-6-7-16-8-12(13)15;1-2-4-13-11(3-1)7-10-16(13)15-12-5-8-14-9-6-12/h4-9,11-12H,3,10H2,1-2H3;4-9,11-12H,3,10,18H2,1-2H3;3-11,13H,2,12H2,1H3;2-9H,1H3,(H,16,17);2-9H,15H2,1H3,(H,16,17);1-10H,(H,14,15)
InChIKeyNDYZUXFUWYRHMR-UHFFFAOYSA-N
XLogP20.56
TPSA204.77 Ų
H-Bond Donors5
H-Bond Acceptors20
Rotatable Bonds18
Heavy Atoms113
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001503.87
LogP ≤ 520.56
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1020

Analyze N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine?
The IUPAC name of N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine (CID 159753661) is N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine is CCCN(c1ccncc1)n1ccc2ccccc21.CCCN(c1ccncc1F)n1cc(C)c2ccccc21.CCCN(c1ccncc1N)n1cc(C)c2ccccc21.Cc1cn(Nc2ccncc2F)c2ccccc12.Cc1cn(Nc2ccncc2N)c2ccccc12.c1ccc2c(c1)ccn2Nc1ccncc1.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine?
The InChIKey is NDYZUXFUWYRHMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3.C17H20N4.C16H17N3.C14H12FN3.C14H14N4.C13H11N3/c2*1-3-10-20(17-8-9-19-11-15(17)18)21-12-13(2)14-6-4-5-7-16(14)21;1-2-12-18(15-7-10-17-11-8-15)19-13-9-14-5-3-4-6-16(14)19;2*1-10-9-18(14-5-3-2-4-11(10)14)17-13-6-7-16-8-12(13)15;1-2-4-13-11(3-1)7-10-16(13)15-12-5-8-14-9-6-12/h4-9,11-12H,3,10H2,1-2H3;4-9,11-12H,3,10,18H2,1-2H3;3-11,13H,2,12H2,1H3;2-9H,1H3,(H,16,17);2-9H,15H2,1H3,(H,16,17);1-10H,(H,14,15).
What are the key properties of N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine?
N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine has a molecular weight of 1503.87 g/mol, XLogP of 20.56, 18 rotatable bonds, 5 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)-3-methylindol-1-amine;N-(3-fluoro-4-pyridinyl)-3-methyl-N-propylindol-1-amine;4-N-(3-methylindol-1-yl)-4-N-propylpyridine-3,4-diamine;4-N-(3-methylindol-1-yl)pyridine-3,4-diamine;N-propyl-N-pyridin-4-ylindol-1-amine;N-pyridin-4-ylindol-1-amine is sourced from PubChem (CID 159753661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).