6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine

C14H12ClN3 — CID 115110648

IUPAC6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine
SMILESCn1cc(-c2ccc(N)cn2)c2c(Cl)cccc21
InChIInChI=1S/C14H12ClN3/c1-18-8-10(12-6-5-9(16)7-17-12)14-11(15)3-2-4-13(14)18/h2-8H,16H2,1H3
InChIKeyYNBPPZFGLRVMSP-UHFFFAOYSA-N
MW257.72 g/mol
LogP3.48
Rot. Bonds1

About 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine

6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine (PubChem CID 115110648) has the molecular formula C14H12ClN3 and a molecular weight of 257.72 g/mol. Its IUPAC name is 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine
PubChem CID115110648
Molecular FormulaC14H12ClN3
Molecular Weight257.72 g/mol
Exact Mass257.07
IUPAC Name6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine
SMILESCn1cc(-c2ccc(N)cn2)c2c(Cl)cccc21
InChIInChI=1S/C14H12ClN3/c1-18-8-10(12-6-5-9(16)7-17-12)14-11(15)3-2-4-13(14)18/h2-8H,16H2,1H3
InChIKeyYNBPPZFGLRVMSP-UHFFFAOYSA-N
XLogP3.48
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chloro-1-methylindol-3-yl)-1-methylpyrazol-4-amine
CID 115109191
3-(5-amino-2-pyridinyl)-1-methylindol-7-ol
CID 115110516
6-(4-methylfuran-3-yl)pyridin-3-amine
CID 131014530
[2-(4-chloro-1-methylindol-3-yl)phenyl]-phenylmethanol
CID 175186249
6-(2-chloro-4-methylphenyl)pyridin-3-amine
CID 144687572
(4-chloro-1-methylindol-3-yl)methanol
CID 117119629
6-(5-amino-2-pyridinyl)pyridin-3-amine;dihydrochloride
CID 11557953
5-amino-2-(5-amino-2-pyridinyl)phenol
CID 175138948
6-chloro-2-(4-fluoro-1-methylindol-3-yl)quinoline
CID 18729693
6-(7-chloro-1H-indol-2-yl)pyridin-3-amine
CID 115110380
4-chloro-3-(iodomethyl)-1-methylindole;N,N-dimethylmethanamine
CID 69427691
6-(2,3-dimethoxyphenyl)pyridin-3-amine
CID 82794989

Frequently Asked Questions

What is the IUPAC name of 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine?
The IUPAC name of 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine (CID 115110648) is 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine.
What is the SMILES notation for 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine?
The canonical SMILES for 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine is Cn1cc(-c2ccc(N)cn2)c2c(Cl)cccc21.
What is the InChIKey of 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine?
The InChIKey is YNBPPZFGLRVMSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3/c1-18-8-10(12-6-5-9(16)7-17-12)14-11(15)3-2-4-13(14)18/h2-8H,16H2,1H3.
What are the key properties of 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine?
6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine has a molecular weight of 257.72 g/mol, XLogP of 3.48, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chloro-1-methylindol-3-yl)pyridin-3-amine is sourced from PubChem (CID 115110648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).