1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine

C16H22N2 — CID 115107082

IUPAC1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine
SMILESCNC(C)Cc1cc2ccccc2n1CC1CC1
InChIInChI=1S/C16H22N2/c1-12(17-2)9-15-10-14-5-3-4-6-16(14)18(15)11-13-7-8-13/h3-6,10,12-13,17H,7-9,11H2,1-2H3
InChIKeyFQWIQMPSRYZECF-UHFFFAOYSA-N
MW242.37 g/mol
LogP3.20
Rot. Bonds5

About 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine

1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine (PubChem CID 115107082) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine.

Molecular Properties

Compound Name1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine
PubChem CID115107082
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC Name1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine
SMILESCNC(C)Cc1cc2ccccc2n1CC1CC1
InChIInChI=1S/C16H22N2/c1-12(17-2)9-15-10-14-5-3-4-6-16(14)18(15)11-13-7-8-13/h3-6,10,12-13,17H,7-9,11H2,1-2H3
InChIKeyFQWIQMPSRYZECF-UHFFFAOYSA-N
XLogP3.20
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-bromophenyl)methyl]-1-(cyclopropylmethyl)indole
CID 18946915
2-[1-(cyclopropylmethyl)indol-2-yl]acetic acid
CID 115107125
N-methyl-2-[1-(oxan-4-ylmethyl)indol-2-yl]ethanamine
CID 115107092
1-(cyclopropylmethyl)-2-ethenylindole
CID 138503170
2-[1-(cyclobutylmethyl)indol-2-yl]propanoic acid
CID 115107128
1-[1-ethyl-7-(trifluoromethyl)indol-2-yl]-N-methylpropan-2-amine
CID 117196602
1-[1-(cyclopentylmethyl)indol-3-yl]-N-methylpropan-2-amine
CID 115107196
3-[1-(cyclopentylmethyl)indol-2-yl]butanoic acid
CID 117119019
1-(cyclopropylmethyl)-N-[(3R)-3-hydroxypentyl]indole-2-carboxamide
CID 124851434
N-methyl-1-(5-methyl-1-propan-2-ylindol-2-yl)propan-2-amine
CID 117195171
1-[1-(2-ethylbutyl)indol-2-yl]-N-methylmethanamine
CID 82924833
N-[[1-(3-ethoxypropyl)indol-2-yl]methyl]-2-methylpropan-1-amine
CID 65178002

Frequently Asked Questions

What is the IUPAC name of 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine?
The IUPAC name of 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine (CID 115107082) is 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine.
What is the SMILES notation for 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine?
The canonical SMILES for 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine is CNC(C)Cc1cc2ccccc2n1CC1CC1.
What is the InChIKey of 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine?
The InChIKey is FQWIQMPSRYZECF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-12(17-2)9-15-10-14-5-3-4-6-16(14)18(15)11-13-7-8-13/h3-6,10,12-13,17H,7-9,11H2,1-2H3.
What are the key properties of 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine?
1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine has a molecular weight of 242.37 g/mol, XLogP of 3.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(cyclopropylmethyl)indol-2-yl]-N-methylpropan-2-amine is sourced from PubChem (CID 115107082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).