N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine

C16H15ClN2 — CID 82536377

IUPACN-(3-chloro-4-methylphenyl)-1-methylindol-5-amine
SMILESCc1ccc(Nc2ccc3c(ccn3C)c2)cc1Cl
InChIInChI=1S/C16H15ClN2/c1-11-3-4-14(10-15(11)17)18-13-5-6-16-12(9-13)7-8-19(16)2/h3-10,18H,1-2H3
InChIKeyUANRLSNULDDUBY-UHFFFAOYSA-N
MW270.76 g/mol
LogP4.88
Rot. Bonds2

About N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine

N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine (PubChem CID 82536377) has the molecular formula C16H15ClN2 and a molecular weight of 270.76 g/mol. Its IUPAC name is N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine.

Molecular Properties

Compound NameN-(3-chloro-4-methylphenyl)-1-methylindol-5-amine
PubChem CID82536377
Molecular FormulaC16H15ClN2
Molecular Weight270.76 g/mol
Exact Mass270.09
IUPAC NameN-(3-chloro-4-methylphenyl)-1-methylindol-5-amine
SMILESCc1ccc(Nc2ccc3c(ccn3C)c2)cc1Cl
InChIInChI=1S/C16H15ClN2/c1-11-3-4-14(10-15(11)17)18-13-5-6-16-12(9-13)7-8-19(16)2/h3-10,18H,1-2H3
InChIKeyUANRLSNULDDUBY-UHFFFAOYSA-N
XLogP4.88
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.76
LogP ≤ 54.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-N-(3-chloro-4-methylphenyl)-2-methylbenzene-1,4-diamine
CID 43436245
2,4-dichloro-N-(1-methylindol-5-yl)benzenesulfonamide
CID 59823134
4-chloro-N-(3-chloro-4-methylphenyl)-1,3-thiazol-2-amine
CID 83152094
1-[(1-methylindol-5-yl)amino]propan-2-ol
CID 82539777
6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 63585961
methyl 2-[(1-methylindol-5-yl)amino]acetate
CID 82539684
5-iodo-1-methylindole
CID 11322835
9-(2-aminoethyl)-N-(3-chloro-4-methylphenyl)-5,6,7,8-tetrahydrocarbazol-3-amine;ethane
CID 171793515
N-(3-chloro-4-methylphenyl)-4-pyrrol-1-yl-1,3,5-triazin-2-amine
CID 2730432
N-[(4-methoxyphenyl)methyl]-1-methylindol-5-amine
CID 82539031
4-N-(3-chloro-4-methylphenyl)-2-propan-2-ylpyrimidine-4,6-diamine
CID 80956194
N-(3-chloro-4-methylphenyl)-2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-amine
CID 7338792

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine?
The IUPAC name of N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine (CID 82536377) is N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine.
What is the SMILES notation for N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine?
The canonical SMILES for N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine is Cc1ccc(Nc2ccc3c(ccn3C)c2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine?
The InChIKey is UANRLSNULDDUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2/c1-11-3-4-14(10-15(11)17)18-13-5-6-16-12(9-13)7-8-19(16)2/h3-10,18H,1-2H3.
What are the key properties of N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine?
N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine has a molecular weight of 270.76 g/mol, XLogP of 4.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methylphenyl)-1-methylindol-5-amine is sourced from PubChem (CID 82536377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).