N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine

C17H19N3 — CID 86815165

IUPACN-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine
SMILESCN(CCc1ccncc1)Cc1cccc2[nH]ccc12
InChIInChI=1S/C17H19N3/c1-20(12-8-14-5-9-18-10-6-14)13-15-3-2-4-17-16(15)7-11-19-17/h2-7,9-11,19H,8,12-13H2,1H3
InChIKeyYDERGBZFGKCEIB-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.24
Rot. Bonds5

About N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine

N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine (PubChem CID 86815165) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine.

Molecular Properties

Compound NameN-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine
PubChem CID86815165
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC NameN-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine
SMILESCN(CCc1ccncc1)Cc1cccc2[nH]ccc12
InChIInChI=1S/C17H19N3/c1-20(12-8-14-5-9-18-10-6-14)13-15-3-2-4-17-16(15)7-11-19-17/h2-7,9-11,19H,8,12-13H2,1H3
InChIKeyYDERGBZFGKCEIB-UHFFFAOYSA-N
XLogP3.24
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1H-indol-4-yl)-N-methyl-N-(1H-pyrazol-5-ylmethyl)methanamine
CID 77087606
N-[[2-(aminomethyl)phenyl]methyl]-N-methyl-2-pyridin-4-ylethanamine
CID 54945558
N-(1H-indol-4-ylmethyl)-1-pyridin-4-ylmethanamine
CID 17221052
N-methyl-2-phenyl-N-(pyridin-4-ylmethyl)ethanamine
CID 3817841
N-benzyl-N-methyl-2-pyridin-4-ylethanamine
CID 78793254
N'-benzyl-N-(1H-indol-4-ylmethyl)-N'-methylethane-1,2-diamine
CID 119110220
N'-hydroxy-2-[[methyl(2-pyridin-4-ylethyl)amino]methyl]benzenecarboximidamide
CID 76883735
2-amino-N-(1H-indol-4-yl)-4-pyridin-4-ylbutanamide
CID 167743849
2-[methyl(2-pyridin-4-ylethyl)amino]-1-(1H-pyrrol-2-yl)ethanone
CID 54943540
N-(1H-indol-4-ylmethyl)-N-methyl-3-[4-(trifluoromethyl)phenyl]prop-2-en-1-amine
CID 176731995
2-[[1H-indol-4-ylmethyl(methyl)amino]methyl]prop-2-enoic acid;2,2,2-trifluoroacetic acid
CID 166356632
N-[(4-iodophenyl)methyl]-N-methyl-2-pyridin-4-ylethanamine
CID 65478370

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine?
The IUPAC name of N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine (CID 86815165) is N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine.
What is the SMILES notation for N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine?
The canonical SMILES for N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine is CN(CCc1ccncc1)Cc1cccc2[nH]ccc12.
What is the InChIKey of N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine?
The InChIKey is YDERGBZFGKCEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-20(12-8-14-5-9-18-10-6-14)13-15-3-2-4-17-16(15)7-11-19-17/h2-7,9-11,19H,8,12-13H2,1H3.
What are the key properties of N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine?
N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine has a molecular weight of 265.36 g/mol, XLogP of 3.24, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-4-ylmethyl)-N-methyl-2-pyridin-4-ylethanamine is sourced from PubChem (CID 86815165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).