N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine

C16H24N2 — CID 80577124

IUPACN-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine
SMILESCCN(CCC1CNc2ccccc21)CC1CC1
InChIInChI=1S/C16H24N2/c1-2-18(12-13-7-8-13)10-9-14-11-17-16-6-4-3-5-15(14)16/h3-6,13-14,17H,2,7-12H2,1H3
InChIKeyBOGGVEMKJBCPIC-UHFFFAOYSA-N
MW244.38 g/mol
LogP3.32
Rot. Bonds6

About N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine

N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine (PubChem CID 80577124) has the molecular formula C16H24N2 and a molecular weight of 244.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine
PubChem CID80577124
Molecular FormulaC16H24N2
Molecular Weight244.38 g/mol
Exact Mass244.19
IUPAC NameN-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine
SMILESCCN(CCC1CNc2ccccc21)CC1CC1
InChIInChI=1S/C16H24N2/c1-2-18(12-13-7-8-13)10-9-14-11-17-16-6-4-3-5-15(14)16/h3-6,13-14,17H,2,7-12H2,1H3
InChIKeyBOGGVEMKJBCPIC-UHFFFAOYSA-N
XLogP3.32
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.38
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-N-methylcycloheptanamine
CID 80577083
N-(2,3-dihydro-1H-indol-3-ylmethyl)-N-methylethanamine
CID 80567242
N-(2,3-dihydro-1H-indol-3-ylmethyl)-N-ethyl-2,2,2-trifluoroethanamine
CID 80566518
(3R)-3-ethyl-2,3-dihydro-1H-indole
CID 92797412
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-N-ethyl-1-methoxypropan-2-amine
CID 80577137
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-N,2-dimethyloxolan-3-amine
CID 82739817
N'-(2,3-dihydro-1H-indol-3-ylmethyl)-N,N,N'-trimethylethane-1,2-diamine
CID 80566631
N-(2,3-dihydro-1H-indol-3-ylmethyl)-N-methylpentan-1-amine
CID 80567043
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-N-(2,2,2-trifluoroethyl)cyclopropanamine
CID 80577154
N-(2,3-dihydro-1H-indol-3-ylmethyl)-N-(2,2,2-trifluoroethyl)propan-1-amine
CID 80566592
N-[2-(2,3-dihydro-1H-indol-3-yl)ethyl]-N-(2,2,2-trifluoroethyl)propan-2-amine
CID 80577188
2-(2,3-dihydro-1H-indol-3-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 80577284

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine?
The IUPAC name of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine (CID 80577124) is N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine.
What is the SMILES notation for N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine?
The canonical SMILES for N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine is CCN(CCC1CNc2ccccc21)CC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine?
The InChIKey is BOGGVEMKJBCPIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2/c1-2-18(12-13-7-8-13)10-9-14-11-17-16-6-4-3-5-15(14)16/h3-6,13-14,17H,2,7-12H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine?
N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine has a molecular weight of 244.38 g/mol, XLogP of 3.32, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-(2,3-dihydro-1H-indol-3-yl)-N-ethylethanamine is sourced from PubChem (CID 80577124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).