1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea

C16H19N3OS — CID 124584937

IUPAC1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea
SMILESCN(Cc1cscn1)C(=O)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C16H19N3OS/c1-19(9-13-10-21-11-17-13)16(20)18-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,10-11,15H,4,6,8-9H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyQJWYBPDNRJPXPZ-OAHLLOKOSA-N
MW301.42 g/mol
LogP3.36
Rot. Bonds3

About 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea

1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea (PubChem CID 124584937) has the molecular formula C16H19N3OS and a molecular weight of 301.42 g/mol. Its IUPAC name is 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea.

Molecular Properties

Compound Name1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea
PubChem CID124584937
Molecular FormulaC16H19N3OS
Molecular Weight301.42 g/mol
Exact Mass301.12
IUPAC Name1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea
SMILESCN(Cc1cscn1)C(=O)N[C@@H]1CCCc2ccccc21
InChIInChI=1S/C16H19N3OS/c1-19(9-13-10-21-11-17-13)16(20)18-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,10-11,15H,4,6,8-9H2,1H3,(H,18,20)/t15-/m1/s1
InChIKeyQJWYBPDNRJPXPZ-OAHLLOKOSA-N
XLogP3.36
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea 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

N-methyl-N-(1,3-thiazol-4-ylmethyl)-3,4-dihydro-1H-isothiochromene-1-carboxamide
CID 71995052
3-(6-fluoro-1,2,3,4-tetrahydronaphthalen-1-yl)-1-methyl-1-[(5-methyl-2-pyridinyl)methyl]urea
CID 119045926
N-cyclopropyl-2-[methyl-[2-oxo-2-[[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]amino]ethyl]amino]acetamide
CID 9053146
2-[benzyl(methyl)amino]-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 8901359
3-[(1S)-2,3-dihydro-1H-inden-1-yl]-1-methyl-1-(4,5,6,7-tetrahydro-1,2-benzoxazol-3-ylmethyl)urea
CID 126443872
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl fluoride
CID 90147743
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-2-thiophen-3-ylacetamide
CID 7688469
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 8712235
1-(2-bromoethyl)-1-[2-iodoethyl(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)amino]-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 91541843
1-cyclobutyl-3-(1,2,3,4-tetrahydronaphthalen-1-yl)urea
CID 115617814
2-cyclopropyl-2-[[methyl(1,3-thiazol-4-ylmethyl)carbamoyl]amino]acetic acid
CID 55107585
2-[methyl-[(2-methylphenyl)methyl]amino]-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
CID 2543063

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea?
The IUPAC name of 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea (CID 124584937) is 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea.
What is the SMILES notation for 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea?
The canonical SMILES for 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea is CN(Cc1cscn1)C(=O)N[C@@H]1CCCc2ccccc21.
What is the InChIKey of 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea?
The InChIKey is QJWYBPDNRJPXPZ-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-19(9-13-10-21-11-17-13)16(20)18-15-8-4-6-12-5-2-3-7-14(12)15/h2-3,5,7,10-11,15H,4,6,8-9H2,1H3,(H,18,20)/t15-/m1/s1.
What are the key properties of 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea?
1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea has a molecular weight of 301.42 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1-(1,3-thiazol-4-ylmethyl)urea is sourced from PubChem (CID 124584937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).