N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine

C16H24N2 — CID 55001070

IUPACN-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine
SMILESCC(C)CN(Cc1ccc2c(c1)CCN2)C1CC1
InChIInChI=1S/C16H24N2/c1-12(2)10-18(15-4-5-15)11-13-3-6-16-14(9-13)7-8-17-16/h3,6,9,12,15,17H,4-5,7-8,10-11H2,1-2H3
InChIKeyXHOAWASSFLCGTJ-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.28
Rot. Bonds5

About N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine

N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine (PubChem CID 55001070) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine
PubChem CID55001070
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine
SMILESCC(C)CN(Cc1ccc2c(c1)CCN2)C1CC1
InChIInChI=1S/C16H24N2/c1-12(2)10-18(15-4-5-15)11-13-3-6-16-14(9-13)7-8-17-16/h3,6,9,12,15,17H,4-5,7-8,10-11H2,1-2H3
InChIKeyXHOAWASSFLCGTJ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine?
The IUPAC name of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine (CID 55001070) is N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine?
The canonical SMILES for N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine is CC(C)CN(Cc1ccc2c(c1)CCN2)C1CC1.
What is the InChIKey of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine?
The InChIKey is XHOAWASSFLCGTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-12(2)10-18(15-4-5-15)11-13-3-6-16-14(9-13)7-8-17-16/h3,6,9,12,15,17H,4-5,7-8,10-11H2,1-2H3.
What are the key properties of N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine?
N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine has a molecular weight of 244.38 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-5-ylmethyl)-N-(2-methylpropyl)cyclopropanamine is sourced from PubChem (CID 55001070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).