N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine

C16H23N3 — CID 106602546

IUPACN-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine
SMILESCN(Cc1cn(C)c2ccccc12)CC1CCCN1
InChIInChI=1S/C16H23N3/c1-18(12-14-6-5-9-17-14)10-13-11-19(2)16-8-4-3-7-15(13)16/h3-4,7-8,11,14,17H,5-6,9-10,12H2,1-2H3
InChIKeyXIFNIKRBTUGXCH-UHFFFAOYSA-N
MW257.38 g/mol
LogP2.36
Rot. Bonds4

About N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine

N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine (PubChem CID 106602546) has the molecular formula C16H23N3 and a molecular weight of 257.38 g/mol. Its IUPAC name is N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine.

Molecular Properties

Compound NameN-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine
PubChem CID106602546
Molecular FormulaC16H23N3
Molecular Weight257.38 g/mol
Exact Mass257.19
IUPAC NameN-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine
SMILESCN(Cc1cn(C)c2ccccc12)CC1CCCN1
InChIInChI=1S/C16H23N3/c1-18(12-14-6-5-9-17-14)10-13-11-19(2)16-8-4-3-7-15(13)16/h3-4,7-8,11,14,17H,5-6,9-10,12H2,1-2H3
InChIKeyXIFNIKRBTUGXCH-UHFFFAOYSA-N
XLogP2.36
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.38
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(isoquinolin-4-ylmethyl)-N-methyl-1-pyrrolidin-2-ylmethanamine
CID 106602512
N-[(1-methylindol-3-yl)methyl]-1-piperidin-2-ylmethanamine
CID 115209330
N,N'-dimethyl-N,N'-bis[(1-methylindol-3-yl)methyl]propane-1,3-diamine
CID 140589591
2-[(3R)-3-[[methyl-[(1-methylindol-3-yl)methyl]amino]methyl]piperidin-1-yl]ethanol
CID 95143050
1-(azepan-2-yl)-N-methyl-N-[(2-methylphenyl)methyl]methanamine
CID 64569172
N-[(1-ethylindol-3-yl)methyl]-N-methyl-1-piperidin-3-ylmethanamine
CID 106623834
N-methyl-1-(1-methylindol-3-yl)-2-pyrrolidin-2-ylethanamine
CID 116951474
1-[[methyl(piperidin-2-ylmethyl)amino]methyl]naphthalen-2-ol
CID 106622937
1-methyl-3-(piperazin-2-ylmethyl)indole
CID 84625891
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-methyl-1-piperidin-2-ylmethanamine
CID 102550778
N-[(3-chloro-2-fluorophenyl)methyl]-N-methyl-1-piperidin-2-ylmethanamine
CID 106622977
N-[[1-(cyclohexylmethyl)indol-3-yl]methyl]-N-methyl-1-piperidin-4-ylmethanamine;hydrochloride
CID 162459944

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine?
The IUPAC name of N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine (CID 106602546) is N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine.
What is the SMILES notation for N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine?
The canonical SMILES for N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine is CN(Cc1cn(C)c2ccccc12)CC1CCCN1.
What is the InChIKey of N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine?
The InChIKey is XIFNIKRBTUGXCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3/c1-18(12-14-6-5-9-17-14)10-13-11-19(2)16-8-4-3-7-15(13)16/h3-4,7-8,11,14,17H,5-6,9-10,12H2,1-2H3.
What are the key properties of N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine?
N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine has a molecular weight of 257.38 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylindol-3-yl)methyl]-1-pyrrolidin-2-ylmethanamine is sourced from PubChem (CID 106602546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).