[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine

C15H19N3 — CID 82477540

IUPAC[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine
SMILESCc1[nH]nc(-c2ccc3c(c2)CCCC3)c1CN
InChIInChI=1S/C15H19N3/c1-10-14(9-16)15(18-17-10)13-7-6-11-4-2-3-5-12(11)8-13/h6-8H,2-5,9,16H2,1H3,(H,17,18)
InChIKeyYDYGTXHKKRZQGL-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.72
Rot. Bonds2

About [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine

[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine (PubChem CID 82477540) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine.

Molecular Properties

Compound Name[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine
PubChem CID82477540
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine
SMILESCc1[nH]nc(-c2ccc3c(c2)CCCC3)c1CN
InChIInChI=1S/C15H19N3/c1-10-14(9-16)15(18-17-10)13-7-6-11-4-2-3-5-12(11)8-13/h6-8H,2-5,9,16H2,1H3,(H,17,18)
InChIKeyYDYGTXHKKRZQGL-UHFFFAOYSA-N
XLogP2.72
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]acetic acid
CID 82488178
[3-(2,3-dihydro-1H-inden-5-yl)-4-methyl-1H-pyrazol-5-yl]methanamine
CID 83850139
[5-methyl-3-[4-(2-methylpropyl)phenyl]-1H-pyrazol-4-yl]methanamine
CID 82478232
[3-(4-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]methanamine
CID 54851145
[2-propan-2-yl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-imidazol-5-yl]methanamine
CID 82305674
4-(2,3-dihydro-1H-inden-5-yl)-5-methyl-1H-imidazol-2-amine
CID 82471020
[4-(2,3-dihydro-1H-inden-5-yl)-3-methylphenyl]methanamine
CID 66481637
[3-(3-butan-2-yloxyphenyl)-5-methyl-1H-pyrazol-4-yl]methanamine
CID 54850935
[5-bromo-1-methyl-4-(5,6,7,8-tetrahydronaphthalen-2-yl)imidazol-2-yl]methanamine
CID 84604334
2-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methyl-1H-pyrazol-4-yl]ethanamine
CID 82483994
2-[3-(1,3-benzodioxol-5-yl)-5-methyl-1H-pyrazol-4-yl]ethanamine
CID 82478929
[3-(4-bromothiophen-2-yl)-5-methyl-1H-pyrazol-4-yl]methanamine
CID 82488409

Frequently Asked Questions

What is the IUPAC name of [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine?
The IUPAC name of [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine (CID 82477540) is [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine.
What is the SMILES notation for [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine?
The canonical SMILES for [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine is Cc1[nH]nc(-c2ccc3c(c2)CCCC3)c1CN.
What is the InChIKey of [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine?
The InChIKey is YDYGTXHKKRZQGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-10-14(9-16)15(18-17-10)13-7-6-11-4-2-3-5-12(11)8-13/h6-8H,2-5,9,16H2,1H3,(H,17,18).
What are the key properties of [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine?
[5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine has a molecular weight of 241.34 g/mol, XLogP of 2.72, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)-1H-pyrazol-4-yl]methanamine is sourced from PubChem (CID 82477540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).