1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine

C14H14N4 — CID 112742650

IUPAC1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine
SMILESCNC(c1ccnnc1)c1c[nH]c2ccccc12
InChIInChI=1S/C14H14N4/c1-15-14(10-6-7-17-18-8-10)12-9-16-13-5-3-2-4-11(12)13/h2-9,14-16H,1H3
InChIKeyCIQRMWGEAVLWJM-UHFFFAOYSA-N
MW238.29 g/mol
LogP2.27
Rot. Bonds3

About 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine

1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine (PubChem CID 112742650) has the molecular formula C14H14N4 and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine.

Molecular Properties

Compound Name1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine
PubChem CID112742650
Molecular FormulaC14H14N4
Molecular Weight238.29 g/mol
Exact Mass238.12
IUPAC Name1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine
SMILESCNC(c1ccnnc1)c1c[nH]c2ccccc12
InChIInChI=1S/C14H14N4/c1-15-14(10-6-7-17-18-8-10)12-9-16-13-5-3-2-4-11(12)13/h2-9,14-16H,1H3
InChIKeyCIQRMWGEAVLWJM-UHFFFAOYSA-N
XLogP2.27
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1H-indol-3-yl)-N-methyl-1-phenylmethanamine
CID 11322318
1-isoquinolin-4-yl-N-methyl-1-pyridazin-4-ylmethanamine
CID 105147444
1-chloro-1-(1H-indol-3-yl)-N-methylmethanamine
CID 116962085
3-propan-2-yl-1H-indole
CID 12534824
2-(1H-indol-3-yl)-2-(methylamino)acetic acid
CID 82469928
N-[1H-indol-3-yl-(1-methylpyrazol-4-yl)methyl]pyrimidin-4-amine
CID 110453184
3-[1H-indol-3-yl(pyridin-4-yl)methyl]-1-methylindole
CID 71444035
1H-indol-3-yl-(2-methyl-4-pyridinyl)methanol
CID 112742788
1-[1-(aminomethyl)cyclopropyl]-1-(1H-indol-3-yl)-N-methylmethanamine
CID 116958427
3-[1H-indol-3-yl-(5-methyl-2-pyridinyl)methyl]-1H-indole
CID 154926412
2-hydroxy-2-(1H-indol-3-yl)-N-methylacetamide
CID 83532275
N-[(4-bromophenyl)-(1H-indol-3-yl)methyl]-4,6-dimethylpyrimidin-2-amine
CID 102051740

Frequently Asked Questions

What is the IUPAC name of 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine?
The IUPAC name of 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine (CID 112742650) is 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine.
What is the SMILES notation for 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine?
The canonical SMILES for 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine is CNC(c1ccnnc1)c1c[nH]c2ccccc12.
What is the InChIKey of 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine?
The InChIKey is CIQRMWGEAVLWJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4/c1-15-14(10-6-7-17-18-8-10)12-9-16-13-5-3-2-4-11(12)13/h2-9,14-16H,1H3.
What are the key properties of 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine?
1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine has a molecular weight of 238.29 g/mol, XLogP of 2.27, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1H-indol-3-yl)-N-methyl-1-pyridazin-4-ylmethanamine is sourced from PubChem (CID 112742650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).