(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide

C11H19N3OS — CID 103814744

IUPAC(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide
SMILESCCC[C@@H](N)C(=O)NC(CC)c1nccs1
InChIInChI=1S/C11H19N3OS/c1-3-5-8(12)10(15)14-9(4-2)11-13-6-7-16-11/h6-9H,3-5,12H2,1-2H3,(H,14,15)/t8-,9?/m1/s1
InChIKeyQJBUOHFTOIVSDE-VEDVMXKPSA-N
MW241.36 g/mol
LogP1.84
Rot. Bonds6

About (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide

(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide (PubChem CID 103814744) has the molecular formula C11H19N3OS and a molecular weight of 241.36 g/mol. Its IUPAC name is (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide
PubChem CID103814744
Molecular FormulaC11H19N3OS
Molecular Weight241.36 g/mol
Exact Mass241.12
IUPAC Name(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide
SMILESCCC[C@@H](N)C(=O)NC(CC)c1nccs1
InChIInChI=1S/C11H19N3OS/c1-3-5-8(12)10(15)14-9(4-2)11-13-6-7-16-11/h6-9H,3-5,12H2,1-2H3,(H,14,15)/t8-,9?/m1/s1
InChIKeyQJBUOHFTOIVSDE-VEDVMXKPSA-N
XLogP1.84
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-phenyl-N-[1-(1,3-thiazol-2-yl)propyl]propanamide;dihydrochloride
CID 119890751
2-(aminomethyl)-4,4-dimethyl-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide
CID 107472241
2-[1-(1,3-thiazol-2-yl)propylamino]pentanoic acid
CID 83041635
2-amino-N-(1,3-thiazol-2-ylmethyl)pentanamide
CID 61283682
2-amino-N-[2-(1,3-thiazol-2-yl)ethyl]pentanamide
CID 63239940
tert-butyl N-[1-(1,3-thiazol-2-yl)propyl]carbamate
CID 64688740
2,2-dimethyl-3-oxo-3-[1-(1,3-thiazol-2-yl)propylamino]propanoic acid
CID 82821210
2-cyclopentyl-N-[(1R)-1-(1,3-thiazol-2-yl)propyl]acetamide
CID 99630332
[(1S)-1-(1,3-thiazol-2-yl)propyl]hydrazine
CID 124537574
3-amino-3-phenyl-N-[1-(1,3-thiazol-2-yl)propyl]propanamide;dihydrochloride
CID 119954007
2-(1-aminoethyl)-N-[1-(1,3-thiazol-2-yl)propyl]-1,3-thiazole-4-carboxamide
CID 66389189
1-(1,3-oxazol-2-yl)-3-[(1R)-1-(1,3-thiazol-2-yl)propyl]urea
CID 97307926

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide?
The IUPAC name of (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide (CID 103814744) is (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide.
What is the SMILES notation for (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide?
The canonical SMILES for (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide is CCC[C@@H](N)C(=O)NC(CC)c1nccs1.
What is the InChIKey of (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide?
The InChIKey is QJBUOHFTOIVSDE-VEDVMXKPSA-N. The full InChI is InChI=1S/C11H19N3OS/c1-3-5-8(12)10(15)14-9(4-2)11-13-6-7-16-11/h6-9H,3-5,12H2,1-2H3,(H,14,15)/t8-,9?/m1/s1.
What are the key properties of (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide?
(2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide has a molecular weight of 241.36 g/mol, XLogP of 1.84, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-[1-(1,3-thiazol-2-yl)propyl]pentanamide is sourced from PubChem (CID 103814744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).