2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine

C19H30N2 — CID 83149656

IUPAC2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine
SMILESCC(C)CCCn1ccc2ccc(CNCC(C)C)cc21
InChIInChI=1S/C19H30N2/c1-15(2)6-5-10-21-11-9-18-8-7-17(12-19(18)21)14-20-13-16(3)4/h7-9,11-12,15-16,20H,5-6,10,13-14H2,1-4H3
InChIKeyGLJGQLZGQAKZAC-UHFFFAOYSA-N
MW286.46 g/mol
LogP4.82
Rot. Bonds8

About 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine

2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine (PubChem CID 83149656) has the molecular formula C19H30N2 and a molecular weight of 286.46 g/mol. Its IUPAC name is 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine
PubChem CID83149656
Molecular FormulaC19H30N2
Molecular Weight286.46 g/mol
Exact Mass286.24
IUPAC Name2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine
SMILESCC(C)CCCn1ccc2ccc(CNCC(C)C)cc21
InChIInChI=1S/C19H30N2/c1-15(2)6-5-10-21-11-9-18-8-7-17(12-19(18)21)14-20-13-16(3)4/h7-9,11-12,15-16,20H,5-6,10,13-14H2,1-4H3
InChIKeyGLJGQLZGQAKZAC-UHFFFAOYSA-N
XLogP4.82
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.46
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-N-[[1-(4-methylpentyl)indol-6-yl]methyl]ethanamine
CID 83149657
1-[6-[(2-methylpropylamino)methyl]indol-1-yl]propan-2-ol
CID 102917013
4-[6-[(tert-butylamino)methyl]indol-1-yl]butan-2-ol
CID 102916969
3-[6-(ethylaminomethyl)indol-1-yl]-N,N-dimethylpropan-1-amine
CID 102916680
3-[5-[(2-methylpropylamino)methyl]indol-1-yl]propanamide
CID 102916282
1-[1-(3-methylbutyl)indol-6-yl]butan-2-amine
CID 102917961
2-[6-(methylaminomethyl)indol-1-yl]ethanol
CID 102916522
6-bromo-1-(3-methylbutyl)indole
CID 116621828
N-methyl-1-[1-(3-methylbut-3-enyl)indol-6-yl]methanamine
CID 114477146
2-methyl-3-[5-[(2-methylpropylamino)methyl]indol-1-yl]propan-1-ol
CID 102916325
2-methyl-N-[[1-(2-methylprop-2-enyl)indol-5-yl]methyl]propan-1-amine
CID 79186203
1-(1-hept-6-enylindol-6-yl)-N-methylmethanamine
CID 107010398

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine (CID 83149656) is 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine is CC(C)CCCn1ccc2ccc(CNCC(C)C)cc21.
What is the InChIKey of 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine?
The InChIKey is GLJGQLZGQAKZAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2/c1-15(2)6-5-10-21-11-9-18-8-7-17(12-19(18)21)14-20-13-16(3)4/h7-9,11-12,15-16,20H,5-6,10,13-14H2,1-4H3.
What are the key properties of 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine?
2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine has a molecular weight of 286.46 g/mol, XLogP of 4.82, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-(4-methylpentyl)indol-6-yl]methyl]propan-1-amine is sourced from PubChem (CID 83149656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).