N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine

C15H20N2 — CID 82494846

IUPACN-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine
SMILESCc1cc(C)c2[nH]cc(CCNC3CC3)c2c1
InChIInChI=1S/C15H20N2/c1-10-7-11(2)15-14(8-10)12(9-17-15)5-6-16-13-3-4-13/h7-9,13,16-17H,3-6H2,1-2H3
InChIKeyOBPNBAXSMZXOQE-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.08
Rot. Bonds4

About N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine

N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine (PubChem CID 82494846) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine
PubChem CID82494846
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC NameN-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine
SMILESCc1cc(C)c2[nH]cc(CCNC3CC3)c2c1
InChIInChI=1S/C15H20N2/c1-10-7-11(2)15-14(8-10)12(9-17-15)5-6-16-13-3-4-13/h7-9,13,16-17H,3-6H2,1-2H3
InChIKeyOBPNBAXSMZXOQE-UHFFFAOYSA-N
XLogP3.08
TPSA27.82 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]acetamide
CID 167080571
3-(5,7-dimethyl-1H-indol-3-yl)-N-propan-2-ylpropan-1-amine
CID 96674980
5,7-dimethyl-3-(piperidin-4-ylmethyl)-1H-indole
CID 82497303
1-(5,7-dimethyl-1H-indol-3-yl)-N-methylmethanamine
CID 82490831
N-[2-(6-methyl-1H-indol-3-yl)ethyl]cyclopentanamine
CID 82497315
2-(5,7-dimethyl-1H-indol-3-yl)acetonitrile
CID 82490743
N-[3-(4,7-dimethyl-1H-indol-3-yl)propyl]cyclopropanamine
CID 96674667
N-[2-(2-methoxy-3,5-dimethylphenyl)ethyl]piperidin-4-amine
CID 115118462
N-[2-(4,6-dimethyl-1-benzofuran-3-yl)ethyl]cyclopropanamine
CID 81047329
N-[2-(5-fluoro-1H-indol-3-yl)ethyl]cyclopropanamine
CID 82493570
N-[(6,7-dimethyl-1H-indol-3-yl)methyl]cyclopropanamine
CID 84622010
N-[2-(7-fluoro-1H-indol-3-yl)ethyl]cyclopentanamine
CID 82498246

Frequently Asked Questions

What is the IUPAC name of N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine?
The IUPAC name of N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine (CID 82494846) is N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine.
What is the SMILES notation for N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine?
The canonical SMILES for N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine is Cc1cc(C)c2[nH]cc(CCNC3CC3)c2c1.
What is the InChIKey of N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine?
The InChIKey is OBPNBAXSMZXOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-10-7-11(2)15-14(8-10)12(9-17-15)5-6-16-13-3-4-13/h7-9,13,16-17H,3-6H2,1-2H3.
What are the key properties of N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine?
N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine has a molecular weight of 228.34 g/mol, XLogP of 3.08, 4 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5,7-dimethyl-1H-indol-3-yl)ethyl]cyclopropanamine is sourced from PubChem (CID 82494846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).