N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine

C16H16N4 — CID 80648541

IUPACN-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine
SMILESc1cc2c(c(CNc3ccc4[nH]ncc4c3)c1)NCC2
InChIInChI=1S/C16H16N4/c1-2-11-6-7-17-16(11)12(3-1)9-18-14-4-5-15-13(8-14)10-19-20-15/h1-5,8,10,17-18H,6-7,9H2,(H,19,20)
InChIKeyKDRLKJCGBOHTMJ-UHFFFAOYSA-N
MW264.33 g/mol
LogP3.14
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine

N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine (PubChem CID 80648541) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine
PubChem CID80648541
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC NameN-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine
SMILESc1cc2c(c(CNc3ccc4[nH]ncc4c3)c1)NCC2
InChIInChI=1S/C16H16N4/c1-2-11-6-7-17-16(11)12(3-1)9-18-14-4-5-15-13(8-14)10-19-20-15/h1-5,8,10,17-18H,6-7,9H2,(H,19,20)
InChIKeyKDRLKJCGBOHTMJ-UHFFFAOYSA-N
XLogP3.14
TPSA52.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 53.14
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-(2,3-dihydro-1H-indol-7-ylmethyl)aniline
CID 80648678
N-(2,3-dihydro-1H-indol-7-ylmethyl)-3,4-dimethoxyaniline
CID 80650262
N-(2,3-dihydro-1H-indol-7-ylmethyl)-2,3-dihydro-1,4-benzodioxin-6-amine
CID 80648500
N-(2,3-dihydro-1H-indol-7-ylmethyl)-5-fluoropyridin-3-amine
CID 114254338
5-N-(2,3-dihydro-1H-indol-7-ylmethyl)-2-N,2-N-dimethylpyridine-2,5-diamine
CID 80648539
N-[(2,4,5-trimethylphenyl)methyl]-1H-indazol-5-amine
CID 43782695
N-(2,3-dihydro-1H-indol-7-ylmethyl)-4-(trifluoromethyl)aniline
CID 80650265
N-(2,3-dihydro-1H-indol-7-ylmethyl)-6-methylsulfonylpyridin-3-amine
CID 80649324
N-(2,3-dihydro-1H-indol-7-ylmethyl)-4-fluoro-3-methoxyaniline
CID 114838905
N-(2,3-dihydro-1H-indol-7-ylmethyl)isoquinolin-8-amine
CID 80648918
N-(quinolin-8-ylmethyl)-1H-indazol-6-amine
CID 43743373
2-[4-(2,3-dihydro-1H-indol-7-ylmethylamino)phenyl]acetonitrile
CID 80650196

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine?
The IUPAC name of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine (CID 80648541) is N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine is c1cc2c(c(CNc3ccc4[nH]ncc4c3)c1)NCC2.
What is the InChIKey of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine?
The InChIKey is KDRLKJCGBOHTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c1-2-11-6-7-17-16(11)12(3-1)9-18-14-4-5-15-13(8-14)10-19-20-15/h1-5,8,10,17-18H,6-7,9H2,(H,19,20).
What are the key properties of N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine?
N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine has a molecular weight of 264.33 g/mol, XLogP of 3.14, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-7-ylmethyl)-1H-indazol-5-amine is sourced from PubChem (CID 80648541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).