1-(1-propylindol-3-yl)propan-2-amine

C14H20N2 — CID 14739622

IUPAC1-(1-propylindol-3-yl)propan-2-amine
SMILESCCCn1cc(CC(C)N)c2ccccc21
InChIInChI=1S/C14H20N2/c1-3-8-16-10-12(9-11(2)15)13-6-4-5-7-14(13)16/h4-7,10-11H,3,8-9,15H2,1-2H3
InChIKeyYISGDWSLBBTJAE-UHFFFAOYSA-N
MW216.33 g/mol
LogP2.94
Rot. Bonds4

About 1-(1-propylindol-3-yl)propan-2-amine

1-(1-propylindol-3-yl)propan-2-amine (PubChem CID 14739622) has the molecular formula C14H20N2 and a molecular weight of 216.33 g/mol. Its IUPAC name is 1-(1-propylindol-3-yl)propan-2-amine.

Molecular Properties

Compound Name1-(1-propylindol-3-yl)propan-2-amine
PubChem CID14739622
Molecular FormulaC14H20N2
Molecular Weight216.33 g/mol
Exact Mass216.16
IUPAC Name1-(1-propylindol-3-yl)propan-2-amine
SMILESCCCn1cc(CC(C)N)c2ccccc21
InChIInChI=1S/C14H20N2/c1-3-8-16-10-12(9-11(2)15)13-6-4-5-7-14(13)16/h4-7,10-11H,3,8-9,15H2,1-2H3
InChIKeyYISGDWSLBBTJAE-UHFFFAOYSA-N
XLogP2.94
TPSA30.95 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.33
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Indole
CID 798
Skatole
CID 6736
Tryptamine
CID 1150
Sumatriptan
CID 5358
N,N-Dimethyltryptamine
CID 6089
3,3'-Diindolylmethane
CID 3071
Gramine
CID 6890
Beta-Carboline
CID 64961
(+-)-alpha-Methyltryptamine
CID 9287
Methyltryptamine
CID 6088
Tetrahydro-beta-carboline
CID 107838
Indalpine
CID 44668

Frequently Asked Questions

What is the IUPAC name of 1-(1-propylindol-3-yl)propan-2-amine?
The IUPAC name of 1-(1-propylindol-3-yl)propan-2-amine (CID 14739622) is 1-(1-propylindol-3-yl)propan-2-amine.
What is the SMILES notation for 1-(1-propylindol-3-yl)propan-2-amine?
The canonical SMILES for 1-(1-propylindol-3-yl)propan-2-amine is CCCn1cc(CC(C)N)c2ccccc21.
What is the InChIKey of 1-(1-propylindol-3-yl)propan-2-amine?
The InChIKey is YISGDWSLBBTJAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2/c1-3-8-16-10-12(9-11(2)15)13-6-4-5-7-14(13)16/h4-7,10-11H,3,8-9,15H2,1-2H3.
What are the key properties of 1-(1-propylindol-3-yl)propan-2-amine?
1-(1-propylindol-3-yl)propan-2-amine has a molecular weight of 216.33 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-propylindol-3-yl)propan-2-amine is sourced from PubChem (CID 14739622), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).