[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine

C15H18N4 — CID 103005659

IUPAC[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine
SMILESCn1cc(CCn2ccc3cccc(CN)c32)cn1
InChIInChI=1S/C15H18N4/c1-18-11-12(10-17-18)5-7-19-8-6-13-3-2-4-14(9-16)15(13)19/h2-4,6,8,10-11H,5,7,9,16H2,1H3
InChIKeySKTCJZWRQMEHQU-UHFFFAOYSA-N
MW254.34 g/mol
LogP2.08
Rot. Bonds4

About [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine

[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine (PubChem CID 103005659) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine.

Molecular Properties

Compound Name[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine
PubChem CID103005659
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine
SMILESCn1cc(CCn2ccc3cccc(CN)c32)cn1
InChIInChI=1S/C15H18N4/c1-18-11-12(10-17-18)5-7-19-8-6-13-3-2-4-14(9-16)15(13)19/h2-4,6,8,10-11H,5,7,9,16H2,1H3
InChIKeySKTCJZWRQMEHQU-UHFFFAOYSA-N
XLogP2.08
TPSA48.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine 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-[2-(1-methylpyrazol-4-yl)ethyl]indole-7-carbaldehyde
CID 103005409
1-[2-(1-methylpyrazol-4-yl)ethyl]-7-nitroindole
CID 103015566
[1-(3,3,3-trifluoropropyl)indol-7-yl]methanamine
CID 102913583
1-[2-(1-methylpyrazol-4-yl)ethyl]indol-6-amine
CID 103002340
2-(aminomethyl)-N,6-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]aniline
CID 107105590
[1-(3-ethylsulfanylpropyl)indol-7-yl]methanamine
CID 113474456
2-(1-propylindol-7-yl)ethanamine
CID 102917066
1-[(1-methylpyrazol-4-yl)methyl]indole
CID 55238822
2-[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-3-yl]ethanamine
CID 103015036
2-[1-(2-thiophen-3-ylethyl)indol-7-yl]ethanamine
CID 102917113
[1-[(2-methoxy-3-pyridinyl)methyl]indol-7-yl]methanamine
CID 102913706
[1-[(3,5-difluorophenyl)methyl]indol-7-yl]methanamine
CID 105409601

Frequently Asked Questions

What is the IUPAC name of [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine?
The IUPAC name of [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine (CID 103005659) is [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine.
What is the SMILES notation for [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine?
The canonical SMILES for [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine is Cn1cc(CCn2ccc3cccc(CN)c32)cn1.
What is the InChIKey of [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine?
The InChIKey is SKTCJZWRQMEHQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-18-11-12(10-17-18)5-7-19-8-6-13-3-2-4-14(9-16)15(13)19/h2-4,6,8,10-11H,5,7,9,16H2,1H3.
What are the key properties of [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine?
[1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine has a molecular weight of 254.34 g/mol, XLogP of 2.08, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2-(1-methylpyrazol-4-yl)ethyl]indol-7-yl]methanamine is sourced from PubChem (CID 103005659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).