N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine

C12H15N3 — CID 174738467

IUPACN-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine
SMILESCNC(Cc1ccccc1)c1cn[nH]c1
InChIInChI=1S/C12H15N3/c1-13-12(11-8-14-15-9-11)7-10-5-3-2-4-6-10/h2-6,8-9,12-13H,7H2,1H3,(H,14,15)
InChIKeyVKHRANNPZXKKMV-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.91
Rot. Bonds4

About N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine

N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine (PubChem CID 174738467) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine
PubChem CID174738467
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC NameN-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine
SMILESCNC(Cc1ccccc1)c1cn[nH]c1
InChIInChI=1S/C12H15N3/c1-13-12(11-8-14-15-9-11)7-10-5-3-2-4-6-10/h2-6,8-9,12-13H,7H2,1H3,(H,14,15)
InChIKeyVKHRANNPZXKKMV-UHFFFAOYSA-N
XLogP1.91
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine 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

(2R,3S)-3-amino-4-phenyl-1-[1-(1H-pyrazol-4-yl)propylamino]butan-2-ol
CID 66614400
3-phenyl-2-(1H-pyrazol-4-yl)propanal
CID 174619368
1-(3,4-difluorophenyl)-N-methyl-2-phenylethanamine
CID 43484623
3-phenyl-2-(1H-pyrazol-4-yl)propanamide
CID 91102712
(2S)-2-amino-3-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]propanamide
CID 106212809
N-methyl-2-phenyl-1-pyrimidin-2-ylethanamine
CID 60820448
1-(3-fluoro-4-methylphenyl)-N-methyl-2-phenylethanamine
CID 60820090
2-(4-iodophenyl)-N-methyl-1-phenylethanamine
CID 65479327
1-[4-(benzenesulfonamido)phenyl]-3-[2-(4-methoxyphenyl)-1-(1H-pyrazol-4-yl)ethyl]urea
CID 135223126
3,3-dimethyl-1-phenyl-N-[1-(1H-pyrazol-4-yl)ethyl]butan-1-amine
CID 106209318
N-methyl-1-naphthalen-2-yl-2-pyridin-3-ylethanamine
CID 62791095
N-methyl-1-(2-methylphenyl)-2-phenylethanamine
CID 60819180

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine?
The IUPAC name of N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine (CID 174738467) is N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine.
What is the SMILES notation for N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine?
The canonical SMILES for N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine is CNC(Cc1ccccc1)c1cn[nH]c1.
What is the InChIKey of N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine?
The InChIKey is VKHRANNPZXKKMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-13-12(11-8-14-15-9-11)7-10-5-3-2-4-6-10/h2-6,8-9,12-13H,7H2,1H3,(H,14,15).
What are the key properties of N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine?
N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine has a molecular weight of 201.27 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-phenyl-1-(1H-pyrazol-4-yl)ethanamine is sourced from PubChem (CID 174738467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).