N-methyl-2-(1-propylindol-5-yl)ethanamine

C14H20N2 — CID 115106808

IUPACN-methyl-2-(1-propylindol-5-yl)ethanamine
SMILESCCCn1ccc2cc(CCNC)ccc21
InChIInChI=1S/C14H20N2/c1-3-9-16-10-7-13-11-12(6-8-15-2)4-5-14(13)16/h4-5,7,10-11,15H,3,6,8-9H2,1-2H3
InChIKeyYEFMTWKUNGBQOR-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.81
Rot. Bonds5

About N-methyl-2-(1-propylindol-5-yl)ethanamine

N-methyl-2-(1-propylindol-5-yl)ethanamine (PubChem CID 115106808) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is N-methyl-2-(1-propylindol-5-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-propylindol-5-yl)ethanamine
PubChem CID115106808
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC NameN-methyl-2-(1-propylindol-5-yl)ethanamine
SMILESCCCn1ccc2cc(CCNC)ccc21
InChIInChI=1S/C14H20N2/c1-3-9-16-10-7-13-11-12(6-8-15-2)4-5-14(13)16/h4-5,7,10-11,15H,3,6,8-9H2,1-2H3
InChIKeyYEFMTWKUNGBQOR-UHFFFAOYSA-N
XLogP2.81
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1-butylindol-5-yl)methanol
CID 102912394
1-[1-(3-ethoxypropyl)indol-5-yl]-N-methylmethanamine
CID 65178006
3-(1-hexylindol-5-yl)propanoic acid
CID 20770765
2-[5-(ethylaminomethyl)indol-1-yl]ethanol
CID 102915827
N-methyl-1-[1-[2-(1-methylimidazol-2-yl)ethyl]indol-5-yl]methanamine
CID 114532036
N-[(1-pent-3-ynylindol-5-yl)methyl]propan-1-amine
CID 104811726
5-ethyl-1-(2-methoxyethyl)indole
CID 71073272
N-methyl-1-[1-(3-pyrrolidin-1-ylpropyl)indol-5-yl]methanamine
CID 102915720
3-[5-(ethylaminomethyl)indol-1-yl]propan-1-ol
CID 102915831
N-butyl-2-[5-(methylaminomethyl)indol-1-yl]acetamide
CID 102915746
1-[1-(2-tert-butylsulfonylethyl)indol-5-yl]-N-methylmethanamine
CID 106717836
2,2-dimethyl-5-[5-(methylaminomethyl)indol-1-yl]pentanenitrile
CID 102915726

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-propylindol-5-yl)ethanamine?
The IUPAC name of N-methyl-2-(1-propylindol-5-yl)ethanamine (CID 115106808) is N-methyl-2-(1-propylindol-5-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(1-propylindol-5-yl)ethanamine?
The canonical SMILES for N-methyl-2-(1-propylindol-5-yl)ethanamine is CCCn1ccc2cc(CCNC)ccc21.
What is the InChIKey of N-methyl-2-(1-propylindol-5-yl)ethanamine?
The InChIKey is YEFMTWKUNGBQOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-3-9-16-10-7-13-11-12(6-8-15-2)4-5-14(13)16/h4-5,7,10-11,15H,3,6,8-9H2,1-2H3.
What are the key properties of N-methyl-2-(1-propylindol-5-yl)ethanamine?
N-methyl-2-(1-propylindol-5-yl)ethanamine has a molecular weight of 216.33 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-propylindol-5-yl)ethanamine is sourced from PubChem (CID 115106808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).