N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline

C14H20N4 — CID 105148624

IUPACN,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline
SMILESCNC(c1cccc(N(C)C)c1)c1ccnn1C
InChIInChI=1S/C14H20N4/c1-15-14(13-8-9-16-18(13)4)11-6-5-7-12(10-11)17(2)3/h5-10,14-15H,1-4H3
InChIKeyQMQBRGJHKJQVRJ-UHFFFAOYSA-N
MW244.34 g/mol
LogP1.79
Rot. Bonds4

About N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline

N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline (PubChem CID 105148624) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline.

Molecular Properties

Compound NameN,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline
PubChem CID105148624
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC NameN,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline
SMILESCNC(c1cccc(N(C)C)c1)c1ccnn1C
InChIInChI=1S/C14H20N4/c1-15-14(13-8-9-16-18(13)4)11-6-5-7-12(10-11)17(2)3/h5-10,14-15H,1-4H3
InChIKeyQMQBRGJHKJQVRJ-UHFFFAOYSA-N
XLogP1.79
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-ethylphenyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 63962866
1-[3-fluoro-4-(trifluoromethyl)phenyl]-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 107291694
1-(3-bromo-4-methoxyphenyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 115858716
3-[(3-methoxypyrazin-2-yl)-(methylamino)methyl]-N,N-dimethylaniline
CID 105178666
N,N-dimethyl-3-[(1S)-1-(methylamino)ethyl]aniline
CID 130697779
3-[hydrazinyl(phenyl)methyl]-N,N-dimethylaniline
CID 105282900
N-[(3-fluorophenyl)-(2-methylpyrazol-3-yl)methyl]ethanamine
CID 63961805
3-[(1-ethyl-4-methoxypyrazol-5-yl)-(methylamino)methyl]-N,N-dimethylaniline
CID 105186646
1-(2-bromo-3-methylphenyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 107984986
N-methyl-1-(2-methylpyrazol-3-yl)-2-phenylpropan-1-amine
CID 114029100
1-(2,4-dimethylphenyl)-N-methyl-1-(2-methylpyrazol-3-yl)methanamine
CID 115858423
3-[2,3-dihydro-1-benzofuran-7-yl(methylamino)methyl]-N,N-dimethylaniline
CID 105189391

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline?
The IUPAC name of N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline (CID 105148624) is N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline.
What is the SMILES notation for N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline?
The canonical SMILES for N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline is CNC(c1cccc(N(C)C)c1)c1ccnn1C.
What is the InChIKey of N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline?
The InChIKey is QMQBRGJHKJQVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4/c1-15-14(13-8-9-16-18(13)4)11-6-5-7-12(10-11)17(2)3/h5-10,14-15H,1-4H3.
What are the key properties of N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline?
N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline has a molecular weight of 244.34 g/mol, XLogP of 1.79, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-[methylamino-(2-methylpyrazol-3-yl)methyl]aniline is sourced from PubChem (CID 105148624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).