N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine

C16H14N4 — CID 62325226

IUPACN-(1H-indol-3-ylmethyl)-1H-indazol-4-amine
SMILESc1ccc2c(CNc3cccc4[nH]ncc34)c[nH]c2c1
InChIInChI=1S/C16H14N4/c1-2-5-14-12(4-1)11(8-17-14)9-18-15-6-3-7-16-13(15)10-19-20-16/h1-8,10,17-18H,9H2,(H,19,20)
InChIKeyHXZWPDTWZBFGDS-UHFFFAOYSA-N
MW262.32 g/mol
LogP3.66
Rot. Bonds3

About N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine

N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine (PubChem CID 62325226) has the molecular formula C16H14N4 and a molecular weight of 262.32 g/mol. Its IUPAC name is N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine.

Molecular Properties

Compound NameN-(1H-indol-3-ylmethyl)-1H-indazol-4-amine
PubChem CID62325226
Molecular FormulaC16H14N4
Molecular Weight262.32 g/mol
Exact Mass262.12
IUPAC NameN-(1H-indol-3-ylmethyl)-1H-indazol-4-amine
SMILESc1ccc2c(CNc3cccc4[nH]ncc34)c[nH]c2c1
InChIInChI=1S/C16H14N4/c1-2-5-14-12(4-1)11(8-17-14)9-18-15-6-3-7-16-13(15)10-19-20-16/h1-8,10,17-18H,9H2,(H,19,20)
InChIKeyHXZWPDTWZBFGDS-UHFFFAOYSA-N
XLogP3.66
TPSA56.50 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.32
LogP ≤ 53.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1H-indol-3-ylmethyl)quinolin-5-amine
CID 60680044
N-[2-[(1H-indazol-4-ylamino)methyl]phenyl]acetamide
CID 66418442
2-[2-[(1H-indazol-4-ylamino)methyl]phenoxy]acetonitrile
CID 60931750
N-(1H-indazol-4-ylmethyl)aniline
CID 91506728
N-(1H-indol-3-ylmethyl)-2-(methoxymethyl)aniline
CID 62332420
N-[(3-chlorophenyl)methyl]-1H-indazol-4-amine
CID 54865712
N-(thiadiazol-4-ylmethyl)-1H-indazol-4-amine
CID 60931620
4-fluoro-2-N-(1H-indol-3-ylmethyl)benzene-1,2-diamine
CID 115124152
N-[(5-bromofuran-2-yl)methyl]-1H-indazol-4-amine
CID 54865678
N-(1H-indol-5-ylmethyl)-1H-indazol-4-amine
CID 102910187
N-[(3-methylthiophen-2-yl)methyl]-1H-indazol-4-amine
CID 54865666
1H-indol-3-ylmethylcyanamide
CID 145401688

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine?
The IUPAC name of N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine (CID 62325226) is N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine.
What is the SMILES notation for N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine?
The canonical SMILES for N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine is c1ccc2c(CNc3cccc4[nH]ncc34)c[nH]c2c1.
What is the InChIKey of N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine?
The InChIKey is HXZWPDTWZBFGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4/c1-2-5-14-12(4-1)11(8-17-14)9-18-15-6-3-7-16-13(15)10-19-20-16/h1-8,10,17-18H,9H2,(H,19,20).
What are the key properties of N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine?
N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine has a molecular weight of 262.32 g/mol, XLogP of 3.66, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-3-ylmethyl)-1H-indazol-4-amine is sourced from PubChem (CID 62325226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).