3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide

C19H26N2OS — CID 56557744

IUPAC3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide
SMILESCC(CCc1ccccc1)CC(=O)NCc1csc(C(C)C)n1
InChIInChI=1S/C19H26N2OS/c1-14(2)19-21-17(13-23-19)12-20-18(22)11-15(3)9-10-16-7-5-4-6-8-16/h4-8,13-15H,9-12H2,1-3H3,(H,20,22)
InChIKeyCSAPASZBLNNZFX-UHFFFAOYSA-N
MW330.50 g/mol
LogP4.54
Rot. Bonds8

About 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide

3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide (PubChem CID 56557744) has the molecular formula C19H26N2OS and a molecular weight of 330.50 g/mol. Its IUPAC name is 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide.

Molecular Properties

Compound Name3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide
PubChem CID56557744
Molecular FormulaC19H26N2OS
Molecular Weight330.50 g/mol
Exact Mass330.18
IUPAC Name3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide
SMILESCC(CCc1ccccc1)CC(=O)NCc1csc(C(C)C)n1
InChIInChI=1S/C19H26N2OS/c1-14(2)19-21-17(13-23-19)12-20-18(22)11-15(3)9-10-16-7-5-4-6-8-16/h4-8,13-15H,9-12H2,1-3H3,(H,20,22)
InChIKeyCSAPASZBLNNZFX-UHFFFAOYSA-N
XLogP4.54
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.50
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
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2-(2-methoxyphenoxy)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
CID 110728083
2-(3-methoxyphenyl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
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2-(2-fluorophenoxy)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
CID 110728111
3-(5-phenylfuran-2-yl)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]propanamide
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1-N,4-N-bis[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]benzene-1,4-dicarboxamide
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methyl N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]carbamate
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2-[2-(1-aminoethyl)-1,3-thiazol-4-yl]-N-(2-phenylethyl)acetamide
CID 82547633
2-amino-2-phenyl-N-[2-(2-propan-2-yl-1,3-thiazol-4-yl)ethyl]acetamide;dihydrochloride
CID 119869430
2-[(2-propan-2-yl-1,3-thiazol-4-yl)methylcarbamoylamino]acetic acid
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N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]nonanamide
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Frequently Asked Questions

What is the IUPAC name of 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide?
The IUPAC name of 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide (CID 56557744) is 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide.
What is the SMILES notation for 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide?
The canonical SMILES for 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide is CC(CCc1ccccc1)CC(=O)NCc1csc(C(C)C)n1.
What is the InChIKey of 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide?
The InChIKey is CSAPASZBLNNZFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2OS/c1-14(2)19-21-17(13-23-19)12-20-18(22)11-15(3)9-10-16-7-5-4-6-8-16/h4-8,13-15H,9-12H2,1-3H3,(H,20,22).
What are the key properties of 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide?
3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide has a molecular weight of 330.50 g/mol, XLogP of 4.54, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-5-phenyl-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]pentanamide is sourced from PubChem (CID 56557744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).