N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine

C16H24N2 — CID 166670394

IUPACN-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine
SMILESCCCCC(Cc1c[nH]c2ccc(C)cc12)NC
InChIInChI=1S/C16H24N2/c1-4-5-6-14(17-3)10-13-11-18-16-8-7-12(2)9-15(13)16/h7-9,11,14,17-18H,4-6,10H2,1-3H3
InChIKeyTZKUQYZYXPCNOR-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.80
Rot. Bonds6

About N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine

N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine (PubChem CID 166670394) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine.

Molecular Properties

Compound NameN-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine
PubChem CID166670394
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine
SMILESCCCCC(Cc1c[nH]c2ccc(C)cc12)NC
InChIInChI=1S/C16H24N2/c1-4-5-6-14(17-3)10-13-11-18-16-8-7-12(2)9-15(13)16/h7-9,11,14,17-18H,4-6,10H2,1-3H3
InChIKeyTZKUQYZYXPCNOR-UHFFFAOYSA-N
XLogP3.80
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5,6-difluoro-1H-indol-3-yl)-N-methylhexan-2-amine
CID 166670459
1-(2-chloro-4-methylphenyl)-N-methyloctan-2-amine
CID 106867862
2-ethyl-N-[2-(5-methyl-1H-indol-3-yl)ethyl]hexanamide
CID 17271853
2-amino-3-(5-methyl-1H-indol-3-yl)propan-1-ol
CID 66932814
(2S)-1-(1H-indol-3-yl)-N-methylbutan-2-amine
CID 96657140
2-amino-3-(5-methyl-1H-indol-3-yl)propanoic acid;hydrate
CID 18530245
(2S)-2-amino-3-(5-methyl-1H-indol-3-yl)propanoic acid;hydrochloride
CID 21122035
2-amino-3-(5-methyl-1H-indol-3-yl)propanoic acid;ethane
CID 145142449
N-methyl-1-(2-methylphenyl)octan-2-amine
CID 62605223
3-(3-methoxypropyl)-5-methyl-1H-indole
CID 66596207
1-(5-chloro-2-methoxyphenyl)-N-methylnonan-2-amine
CID 115845070
1-(5-fluoro-2-methylphenyl)-N-methyldecan-2-amine
CID 105377260

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine?
The IUPAC name of N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine (CID 166670394) is N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine.
What is the SMILES notation for N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine?
The canonical SMILES for N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine is CCCCC(Cc1c[nH]c2ccc(C)cc12)NC.
What is the InChIKey of N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine?
The InChIKey is TZKUQYZYXPCNOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-4-5-6-14(17-3)10-13-11-18-16-8-7-12(2)9-15(13)16/h7-9,11,14,17-18H,4-6,10H2,1-3H3.
What are the key properties of N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine?
N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine has a molecular weight of 244.38 g/mol, XLogP of 3.80, 6 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methyl-1H-indol-3-yl)hexan-2-amine is sourced from PubChem (CID 166670394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).