3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide

C19H30N2OS — CID 118726223

IUPAC3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide
SMILESO=C(CCC1CCCCC1)Nc1ncc(CC2CCCCC2)s1
InChIInChI=1S/C19H30N2OS/c22-18(12-11-15-7-3-1-4-8-15)21-19-20-14-17(23-19)13-16-9-5-2-6-10-16/h14-16H,1-13H2,(H,20,21,22)
InChIKeyDIPHVRPXEZBANP-UHFFFAOYSA-N
MW334.53 g/mol
LogP5.56
Rot. Bonds6

About 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide

3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide (PubChem CID 118726223) has the molecular formula C19H30N2OS and a molecular weight of 334.53 g/mol. Its IUPAC name is 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide.

Molecular Properties

Compound Name3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide
PubChem CID118726223
Molecular FormulaC19H30N2OS
Molecular Weight334.53 g/mol
Exact Mass334.21
IUPAC Name3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide
SMILESO=C(CCC1CCCCC1)Nc1ncc(CC2CCCCC2)s1
InChIInChI=1S/C19H30N2OS/c22-18(12-11-15-7-3-1-4-8-15)21-19-20-14-17(23-19)13-16-9-5-2-6-10-16/h14-16H,1-13H2,(H,20,21,22)
InChIKeyDIPHVRPXEZBANP-UHFFFAOYSA-N
XLogP5.56
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.53
LogP ≤ 55.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-tert-butyl-N-(5-methyl-1,3-thiazol-2-yl)cyclohexane-1-carboxamide
CID 8151663
N,N'-bis[N'-[3-(2-amino-1,3-thiazol-5-yl)propyl]carbamimidoyl]octanediamide
CID 56954129
N,N'-bis[N'-[3-(2-amino-1,3-thiazol-5-yl)propyl]carbamimidoyl]decanediamide
CID 56954227
N,N'-bis[N'-[3-(2-amino-1,3-thiazol-5-yl)propyl]carbamimidoyl]hexadecanediamide
CID 56954229
N-(5-benzylthiazol-2-yl)-2-cyclohexyl-acetamide
CID 118726192
N-(5-benzylthiazol-2-yl)-3-cyclohexyl-propanamide
CID 118726193
3-cyclohexyl-N-(5-phenethylthiazol-2-yl)propanamide
CID 118726219
N-[5-(cyclohexylmethyl)thiazol-2-yl]cyclohexanecarboxamide
CID 118726221
N-[5-(cyclopentylmethyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
CID 145967505
2-cyclopentyl-N-(5-methyl-1,3-thiazol-2-yl)acetamide
CID 2673091
3-cyclopentyl-N-(5-methyl-1,3-thiazol-2-yl)propanamide
CID 897357
N-(5-benzyl-1,3-thiazol-2-yl)cyclohexanecarboxamide
CID 741544

Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide?
The IUPAC name of 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide (CID 118726223) is 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide.
What is the SMILES notation for 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide?
The canonical SMILES for 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide is O=C(CCC1CCCCC1)Nc1ncc(CC2CCCCC2)s1.
What is the InChIKey of 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide?
The InChIKey is DIPHVRPXEZBANP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N2OS/c22-18(12-11-15-7-3-1-4-8-15)21-19-20-14-17(23-19)13-16-9-5-2-6-10-16/h14-16H,1-13H2,(H,20,21,22).
What are the key properties of 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide?
3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide has a molecular weight of 334.53 g/mol, XLogP of 5.56, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-N-[5-(cyclohexylmethyl)-1,3-thiazol-2-yl]propanamide is sourced from PubChem (CID 118726223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).