N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

C16H21N3 — CID 103130976

IUPACN-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCNC(c1ccn(C)n1)C1CCc2ccccc2C1
InChIInChI=1S/C16H21N3/c1-17-16(15-9-10-19(2)18-15)14-8-7-12-5-3-4-6-13(12)11-14/h3-6,9-10,14,16-17H,7-8,11H2,1-2H3
InChIKeyFQVYCKQWUMXYFX-UHFFFAOYSA-N
MW255.37 g/mol
LogP2.49
Rot. Bonds3

About N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine

N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (PubChem CID 103130976) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
PubChem CID103130976
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC NameN-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
SMILESCNC(c1ccn(C)n1)C1CCc2ccccc2C1
InChIInChI=1S/C16H21N3/c1-17-16(15-9-10-19(2)18-15)14-8-7-12-5-3-4-6-13(12)11-14/h3-6,9-10,14,16-17H,7-8,11H2,1-2H3
InChIKeyFQVYCKQWUMXYFX-UHFFFAOYSA-N
XLogP2.49
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methylpyrazol-3-yl)-(1,2,3,4-tetrahydronaphthalen-2-yl)methyl]propan-1-amine
CID 103130978
[2,3-dihydro-1H-inden-2-yl-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 103140273
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 79748631
1-(3-ethylcyclopentyl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine
CID 103130959
N-methyl-1-(2-propylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 65405561
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-2-(1-methylpyrazol-3-yl)ethanamine
CID 82877542
N-[2,3-dihydro-1H-inden-1-yl-(1-methylpyrazol-3-yl)methyl]ethanamine
CID 103130973
1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-1-(1-methylpyrazol-4-yl)methanamine
CID 65409933
1-(3-fluoro-5-methylphenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 79697550
[cyclopropyl-(1-methylpyrazol-3-yl)methyl]hydrazine
CID 105228557
[(1-methylpyrazol-3-yl)-(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]hydrazine
CID 103140093
1-(3-fluoro-4-methylphenyl)-N-methyl-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine
CID 107128830

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The IUPAC name of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine (CID 103130976) is N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine.
What is the SMILES notation for N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The canonical SMILES for N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is CNC(c1ccn(C)n1)C1CCc2ccccc2C1.
What is the InChIKey of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
The InChIKey is FQVYCKQWUMXYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-17-16(15-9-10-19(2)18-15)14-8-7-12-5-3-4-6-13(12)11-14/h3-6,9-10,14,16-17H,7-8,11H2,1-2H3.
What are the key properties of N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine?
N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine has a molecular weight of 255.37 g/mol, XLogP of 2.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(1-methylpyrazol-3-yl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)methanamine is sourced from PubChem (CID 103130976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).