(1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine

C18H21N3 — CID 95133375

IUPAC(1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine
SMILESC[C@H](c1ccccn1)N(C)Cc1cc2ccccc2n1C
InChIInChI=1S/C18H21N3/c1-14(17-9-6-7-11-19-17)20(2)13-16-12-15-8-4-5-10-18(15)21(16)3/h4-12,14H,13H2,1-3H3/t14-/m1/s1
InChIKeyYSHXHYIUIYENTR-CQSZACIVSA-N
MW279.39 g/mol
LogP3.77
Rot. Bonds4

About (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine

(1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine (PubChem CID 95133375) has the molecular formula C18H21N3 and a molecular weight of 279.39 g/mol. Its IUPAC name is (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine.

Molecular Properties

Compound Name(1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine
PubChem CID95133375
Molecular FormulaC18H21N3
Molecular Weight279.39 g/mol
Exact Mass279.17
IUPAC Name(1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine
SMILESC[C@H](c1ccccn1)N(C)Cc1cc2ccccc2n1C
InChIInChI=1S/C18H21N3/c1-14(17-9-6-7-11-19-17)20(2)13-16-12-15-8-4-5-10-18(15)21(16)3/h4-12,14H,13H2,1-3H3/t14-/m1/s1
InChIKeyYSHXHYIUIYENTR-CQSZACIVSA-N
XLogP3.77
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.39
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methyl-3-[[methyl-[(1S)-1-pyrimidin-4-ylethyl]amino]methyl]quinolin-2-one
CID 99946876
N-[(5-ethylfuran-2-yl)methyl]-N-methyl-1-pyridin-2-ylethanamine
CID 50983050
[4-methyl-6-[[methyl-[(1S)-1-pyridin-2-ylethyl]amino]methyl]pyrimidin-2-yl]methanol
CID 138501521
4-(4-methylpiperazin-1-yl)-6-[[methyl-[(1S)-1-pyridin-2-ylethyl]amino]methyl]pyrimidin-2-amine
CID 138501523
(1S)-N-(2,1,3-benzoxadiazol-5-ylmethyl)-N-methyl-1-pyridin-2-ylethanamine
CID 95144676
(1S)-N-methyl-1-pyridin-2-yl-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamine
CID 97314250
N-methyl-1-pyridin-2-yl-N-[[4-(trifluoromethyl)phenyl]methyl]ethanamine
CID 75417275
2-[methyl-[(1R)-1-pyridin-2-ylethyl]amino]acetic acid
CID 95935067
1-pyridin-2-yl-N,N-bis(1-pyridin-2-ylethyl)ethanamine
CID 15806675
(1R)-N-[(1-ethenylpyrazol-4-yl)methyl]-N-methyl-1-pyridin-2-ylethanamine
CID 99841792
2-(bromomethyl)-1-methylindole
CID 58970525
(1R)-N-methyl-1-pyridin-2-yl-N-[[4-(1,2,4-triazol-1-yl)phenyl]methyl]ethanamine
CID 95120319

Frequently Asked Questions

What is the IUPAC name of (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine?
The IUPAC name of (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine (CID 95133375) is (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine.
What is the SMILES notation for (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine?
The canonical SMILES for (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine is C[C@H](c1ccccn1)N(C)Cc1cc2ccccc2n1C.
What is the InChIKey of (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine?
The InChIKey is YSHXHYIUIYENTR-CQSZACIVSA-N. The full InChI is InChI=1S/C18H21N3/c1-14(17-9-6-7-11-19-17)20(2)13-16-12-15-8-4-5-10-18(15)21(16)3/h4-12,14H,13H2,1-3H3/t14-/m1/s1.
What are the key properties of (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine?
(1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine has a molecular weight of 279.39 g/mol, XLogP of 3.77, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-N-methyl-N-[(1-methylindol-2-yl)methyl]-1-pyridin-2-ylethanamine is sourced from PubChem (CID 95133375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).