4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine

C15H14N2S — CID 43637199

IUPAC4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1Cc1ccc2ccccc2c1
InChIInChI=1S/C15H14N2S/c1-10-14(18-15(16)17-10)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8H,9H2,1H3,(H2,16,17)
InChIKeyPCPGYTLLHVYBEI-UHFFFAOYSA-N
MW254.36 g/mol
LogP3.78
Rot. Bonds2

About 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine

4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine (PubChem CID 43637199) has the molecular formula C15H14N2S and a molecular weight of 254.36 g/mol. Its IUPAC name is 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine
PubChem CID43637199
Molecular FormulaC15H14N2S
Molecular Weight254.36 g/mol
Exact Mass254.09
IUPAC Name4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine
SMILESCc1nc(N)sc1Cc1ccc2ccccc2c1
InChIInChI=1S/C15H14N2S/c1-10-14(18-15(16)17-10)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8H,9H2,1H3,(H2,16,17)
InChIKeyPCPGYTLLHVYBEI-UHFFFAOYSA-N
XLogP3.78
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.36
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[(3-chloro-4-fluorophenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 43637228
5-[(4-ethoxyphenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 43431842
4-[(2-amino-4-methyl-1,3-thiazol-5-yl)methyl]benzamide
CID 83969989
2-[4-[(2-amino-4-methyl-1,3-thiazol-5-yl)methyl]phenyl]acetic acid
CID 83969992
2-(naphthalen-2-ylmethyl)naphthalene
CID 14123480
5,7-dimethyl-2,3-bis(naphthalen-2-ylmethyl)thieno[3,4-b]pyrazine
CID 22085763
5-(aminomethyl)-4-methyl-1,3-thiazol-2-amine
CID 24820452
4-methyl-5-(quinolin-8-ylmethyl)-1,3-thiazol-2-amine
CID 43637194
5-[(2-bromo-4-methylphenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 43637240
5-[(2-chloro-6-methylphenyl)methyl]-4-methyl-1,3-thiazol-2-amine
CID 66250186
5-[(3-iodo-4-methylphenyl)methyl]-4-propan-2-yl-1,3-thiazol-2-amine
CID 114257863
5-[(4-fluoro-3-methylphenyl)methyl]-4-propan-2-yl-1,3-thiazol-2-amine
CID 55118846

Frequently Asked Questions

What is the IUPAC name of 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine?
The IUPAC name of 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine (CID 43637199) is 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine is Cc1nc(N)sc1Cc1ccc2ccccc2c1.
What is the InChIKey of 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine?
The InChIKey is PCPGYTLLHVYBEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2S/c1-10-14(18-15(16)17-10)9-11-6-7-12-4-2-3-5-13(12)8-11/h2-8H,9H2,1H3,(H2,16,17).
What are the key properties of 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine?
4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine has a molecular weight of 254.36 g/mol, XLogP of 3.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-5-(naphthalen-2-ylmethyl)-1,3-thiazol-2-amine is sourced from PubChem (CID 43637199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).